broad_id
string | depmap_id
string | ccle_name
string | screen_id
string | upper_limit
int64 | lower_limit
float64 | slope
float64 | r2
float64 | auc
float64 | ec50
float64 | ic50
float64 | name
string | moa
string | target
string | disease.area
string | indication
string | smiles
string | phase
string | passed_str_profiling
bool | row_name
string |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BRD-K53972329-001-07-0
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.969147 | -0.083389 | -0.020743 | 0.984645 | 0.069748 | null |
ruxolitinib
|
JAK inhibitor
|
JAK1, JAK2, JAK3, TYK2
|
hematologic malignancy, hematology
|
myelofibrosis, polycythemia vera
|
N#CC[C@H](C1CCCC1)n1cc(cn1)-c1ncnc2[nH]ccc12
|
Launched
| true |
ACH-001318
|
BRD-K54256913-001-08-7
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.112063 | 1.209823 | 0.726084 | 0.664153 | 0.256972 | 0.316944 |
MK-1775
|
WEE1 kinase inhibitor
|
WEE1
| null | null |
CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(-c2cccc(n2)C(C)(C)O)n(CC=C)c3=O)cc1
|
Phase 2
| true |
ACH-001318
|
BRD-K54955827-001-02-2
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.406463 | 0.460826 | 0.29419 | 1 | 0.030821 | null |
niraparib
|
PARP inhibitor
|
PARP1
|
oncology
|
primary peritoneal cancer (PPC)
|
NC(=O)c1cccc2cn(nc12)-c1ccc(cc1)[C@@H]1CCCNC1, NC(=O)c1cccc2cn(nc12)-c1ccc(cc1)[C@@H]1CCCNC1
|
Launched
| true |
ACH-001318
|
BRD-K54997624-001-06-0
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.988898 | 0.133384 | -0.016588 | 0.992448 | 0.000226 | null |
alpelisib
|
PI3K inhibitor
|
PIK3CA, PIK3CB, PIK3CD, PIK3CG
| null | null |
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F
|
Phase 3
| true |
ACH-001318
|
BRD-K55187425-236-05-2
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.58252 | 0.27304 | 0.171858 | 0.7959 | 0.09407 | null |
rigosertib
|
cell cycle inhibitor, PLK inhibitor
|
PLK1
| null | null |
COc1cc(OC)c(\C=C\S(=O)(=O)Cc2ccc(OC)c(NCC(O)=O)c2)c(OC)c1, COc1cc(OC)c(\C=C\S(=O)(=O)Cc2ccc(OC)c(NCC(O)=O)c2)c(OC)c1, COc1cc(OC)c(\C=C\S(=O)(=O)Cc2ccc(OC)c(NCC(O)=O)c2)c(OC)c1
|
Phase 3
| true |
ACH-001318
|
BRD-K56343971-001-14-8
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.280402 | -0.341978 | -0.008881 | 1 | 0.001483 | null |
vemurafenib
|
RAF inhibitor
|
BRAF, RAF1
|
oncology
|
melanoma
|
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F, CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F, CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F
|
Launched
| true |
ACH-001318
|
BRD-K56981171-001-02-8
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.796045 | -0.038937 | -0.035629 | 0.895483 | 0.281851 | null |
brigatinib
|
ALK tyrosine kinase receptor inhibitor, EGFR inhibitor
|
ALK, EGFR
|
oncology
|
non-small cell lung cancer (NSCLC)
|
COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2P(C)(C)=O)n1)N1CCC(CC1)N1CCN(C)CC1, COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2P(C)(C)=O)n1)N1CCC(CC1)N1CCN(C)CC1
|
Launched
| true |
ACH-001318
|
BRD-K57080016-001-15-9
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.951624 | -0.136827 | -0.090802 | 0.967084 | 23.708551 | null |
selumetinib
|
MEK inhibitor
|
MAP2K1
| null | null |
Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO, Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO
|
Phase 3
| true |
ACH-001318
|
BRD-K57169635-001-04-5
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.195671 | 0.144856 | 0.17699 | 0.640824 | 0.364961 | null |
dacomitinib
|
EGFR inhibitor
|
EGFR, ERBB2, ERBB4
| null | null |
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN1CCCCC1
|
Phase 3
| true |
ACH-001318
|
BRD-K58435339-001-03-0
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.075113 | 0.566331 | 0.506906 | 0.468465 | 0.034137 | 0.045505 |
AT13387
|
HSP antagonist
|
HSP90AA1
| null | null |
CC(C)c1cc(C(=O)N2Cc3ccc(CN4CCN(C)CC4)cc3C2)c(O)cc1O, CC(C)c1cc(C(=O)N2Cc3ccc(CN4CCN(C)CC4)cc3C2)c(O)cc1O
|
Phase 2
| true |
ACH-001318
|
BRD-K58529924-001-01-5
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.335871 | -8.328137 | 0.615358 | 1 | 0.020724 | null |
ONC201
|
AKT inhibitor, MAP kinase inhibitor
|
TNFSF10
| null | null |
Cc1ccccc1CN1C2=NCCN2C2=C(CN(Cc3ccccc3)CC2)C1=O
|
Phase 2
| true |
ACH-001318
|
BRD-K58550667-001-08-7
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.183406 | 7.277212 | 0.567247 | 0.778994 | 0.045199 | 0.048128 |
FK-866
|
niacinamide phosphoribosyltransferase inhibitor
|
NAMPT
| null | null |
O=C(NCCCCC1CCN(CC1)C(=O)c1ccccc1)\C=C\c1cccnc1
|
Phase 2
| true |
ACH-001318
|
BRD-K59317601-001-05-5
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.352156 | 1.166374 | 0.72998 | 0.559796 | 0.013376 | 0.038019 |
MLN0128
|
mTOR inhibitor
|
MTOR, PIK3CA, PIK3CD, PIK3CG
| null | null |
CC(C)n1nc(-c2ccc3oc(N)nc3c2)c2c(N)ncnc12
|
Phase 2
| true |
ACH-001318
|
BRD-K60866521-001-07-1
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.87462 | 0.695647 | 0.095378 | 0.928591 | 0.03784 | null |
idelalisib
|
PI3K inhibitor
|
PIK3CA, PIK3CB, PIK3CD, PIK3CG
|
hematologic malignancy
|
chronic lymphocytic leukemia (CLL)
|
CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(F)c2c(=O)n1-c1ccccc1
|
Launched
| true |
ACH-001318
|
BRD-K60997853-001-02-3
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.504973 | 0.222551 | 0.234275 | 0.797231 | 0.471279 | null |
PHA-848125
|
CDK inhibitor, growth factor receptor inhibitor
|
CDK2, CDK4, CDK7, NTRK1
| null | null |
CNC(=O)c1nn(C)c-2c1C(C)(C)Cc1cnc(Nc3ccc(cc3)N3CCN(C)CC3)nc-21
|
Phase 2
| true |
ACH-001318
|
BRD-K61192372-001-08-9
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.864761 | -0.080285 | -0.010578 | 0.906276 | 2,239.224918 | null |
capecitabine
|
DNA synthesis inhibitor, thymidylate synthase inhibitor
|
TYMS
|
oncology
|
breast cancer, colorectal cancer
|
CCCCCOC(=O)Nc1nc(=O)n(cc1F)[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O, CCCCCOC(=O)Nc1nc(=O)n(cc1F)[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O, CCCCCOC(=O)Nc1nc(=O)n(cc1F)[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O, CCCCCOC(=O)Nc1nc(=O)n(cc1F)[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O
|
Launched
| true |
ACH-001318
|
BRD-K62008436-001-23-9
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.246266 | 5.937642 | 0.617226 | 0.676548 | 0.009707 | 0.010882 |
paclitaxel
|
tubulin polymerization inhibitor
|
BCL2, MAP2, MAP4, MAPT, NR1I2, TLR4, TUBB, TUBB1
|
oncology
|
ovarian cancer, breast cancer, non-small cell lung cancer (NSCLC)
|
CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1, CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1, CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1, CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1, CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1
|
Launched
| true |
ACH-001318
|
BRD-K62196610-001-01-6
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.488068 | 1.969942 | 0.57835 | 0.869832 | 0.851255 | 5.669864 |
AVN-944
|
inosine monophosphate dehydrogenase inhibitor
|
IMPDH1, IMPDH2
| null | null |
CC[C@H](CC#N)OC(=O)N[C@@H](C)c1cccc(NC(=O)Nc2ccc(-c3cnco3)c(OC)c2)c1
|
Phase 2
| true |
ACH-001318
|
BRD-K62200014-003-10-5
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.124465 | -0.195226 | 0.09502 | 1 | 0.059259 | null |
anagrelide
|
phosphodiesterase inhibitor
|
PDE3A
|
hematology, hematologic malignancy
|
thrombocythemia, myeloproliferative neoplasms
|
Clc1ccc2N=C3NC(=O)CN3Cc2c1Cl, Clc1ccc2N=C3NC(=O)CN3Cc2c1Cl, Clc1ccc2N=C3NC(=O)CN3Cc2c1Cl
|
Launched
| true |
ACH-001318
|
BRD-K62391742-001-09-7
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.021593 | -0.663625 | -0.143325 | 1 | 0.164775 | null |
venetoclax
|
BCL inhibitor
|
BCL2
|
hematologic malignancy
|
chronic lymphocytic leukemia (CLL)
|
CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1, CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1, CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1
|
Launched
| true |
ACH-001318
|
BRD-K62627508-001-01-5
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.114931 | 0.08466 | -0.033341 | 1 | 0.001093 | null |
idasanutlin
|
MDM inhibitor
|
MDM2, TP53
| null | null |
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O
|
Phase 3
| true |
ACH-001318
|
BRD-K63504947-001-14-7
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.907278 | -0.01131 | -0.019469 | 0.952428 | 7.946676 | null |
semaxanib
|
VEGFR inhibitor
|
FGFR1, FLT1, KDR, KIT, PDGFRA, PDGFRB, RET
| null | null |
Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1, Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1, Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1, Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1
|
Phase 3
| true |
ACH-001318
|
BRD-K63712959-001-01-8
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.177945 | -0.507743 | -0.201257 | 1 | 0.090345 | null |
temoporfin
|
radical formation stimulant
| null |
oncology
|
head and neck squamous cell carcinoma (HNSCC)
|
Oc1cccc(c1)-c1c2CCc(n2)c(-c2cccc(O)c2)c2ccc([nH]2)c(-c2cccc(O)c2)c2ccc(n2)c(-c2cccc(O)c2)c2ccc1[nH]2
|
Launched
| true |
ACH-001318
|
BRD-K64052750-001-22-5
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.528516 | 4.002668 | 0.571525 | 0.895842 | 1.172013 | null |
gefitinib
|
EGFR inhibitor
|
EGFR
|
oncology
|
non-small cell lung cancer (NSCLC)
|
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1, COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1, COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1, COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
|
Launched
| true |
ACH-001318
|
BRD-K64881305-001-03-7
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.46679 | 3.937217 | 0.580562 | 0.538205 | 0.002234 | 0.004449 |
ispinesib
|
kinesin inhibitor
|
KIF11
| null | null |
CC(C)[C@@H](N(CCCN)C(=O)c1ccc(C)cc1)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1, CC(C)[C@@H](N(CCCN)C(=O)c1ccc(C)cc1)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1, CC(C)[C@@H](N(CCCN)C(=O)c1ccc(C)cc1)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1
|
Phase 2
| true |
ACH-001318
|
BRD-K66175015-001-12-4
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.444544 | 0.521858 | 0.239091 | 0.75856 | 0.164694 | null |
afatinib
|
EGFR inhibitor
|
EGFR, ERBB2, ERBB4
|
oncology
|
non-small cell lung cancer (NSCLC)
|
CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1, CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1, CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1
|
Launched
| true |
ACH-001318
|
BRD-K67844266-003-01-9
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.364381 | 2.269545 | 0.424331 | 0.893797 | 1.998384 | 3.55103 |
pevonedistat
|
nedd activating enzyme inhibitor
|
NAE1, UBA3
| null | null |
NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1ccc2c(N[C@H]3CCc4ccccc34)ncnc12
|
Phase 2
| true |
ACH-001318
|
BRD-K69001009-001-02-8
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.947699 | 0.23332 | 0.020309 | 0.975564 | 0.145413 | null |
golvatinib
|
VEGFR inhibitor
|
KDR, MET
| null | null |
CN1CCN(CC1)C1CCN(CC1)C(=O)Nc1cc(Oc2ccc(NC(=O)C3(CC3)C(=O)Nc3ccc(F)cc3)c(F)c2)ccn1
|
Phase 2
| true |
ACH-001318
|
BRD-K69694239-001-02-2
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.238424 | 4.180904 | 0.77278 | 0.703624 | 0.228988 | 0.26737 |
bardoxolone-methyl
|
nuclear factor erythroid derived, like (NRF2) activator
|
PPARG, STAT3
| null | null |
COC(=O)[C@]12CCC(C)(C)C[C@H]1[C@H]1C(=O)C=C3[C@@]4(C)C=C(C#N)C(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2
|
Phase 3
| true |
ACH-001318
|
BRD-K69776681-001-03-8
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.163087 | 3.496316 | 0.806798 | 0.622022 | 0.124886 | 0.139814 |
volasertib
|
PLK inhibitor
|
PLK1
| null | null |
CC[C@H]1N(C(C)C)c2nc(Nc3ccc(cc3OC)C(=O)N[C@H]3CC[C@@H](CC3)N3CCN(CC4CC4)CC3)ncc2N(C)C1=O, CC[C@H]1N(C(C)C)c2nc(Nc3ccc(cc3OC)C(=O)N[C@H]3CC[C@@H](CC3)N3CCN(CC4CC4)CC3)ncc2N(C)C1=O
|
Phase 3
| true |
ACH-001318
|
BRD-K70301465-001-05-9
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.816668 | 4.385042 | 0.135582 | 0.903684 | 0.061059 | null |
ibrutinib
|
Bruton's tyrosine kinase (BTK) inhibitor
|
BLK, BMX, BTK
|
hematologic malignancy
|
chronic lymphocytic leukemia (CLL), mantle cell lymphoma (MCL), Waldenstrom's macroglobulinemia (WM)
|
Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C, Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C
|
Launched
| true |
ACH-001318
|
BRD-K70401845-001-15-7
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.638539 | 0.158331 | 0.002754 | 0.783248 | 0.005385 | null |
erlotinib
|
EGFR inhibitor
|
EGFR, NR1I2
|
oncology
|
non-small cell lung cancer (NSCLC), pancreatic cancer
|
COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC, COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC
|
Launched
| true |
ACH-001318
|
BRD-K73838513-003-05-5
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.560536 | 0.225629 | 0.122646 | 0.806899 | 0.255403 | null |
cinacalcet
|
calcium channel activator
|
CASR
|
endocrinology, nephrology, oncology
|
hyperparathyroidism, chronic kidney disease (CKD), parathyroid carcinoma, hypercalcemia
|
C[C@@H](NCCCc1cccc(c1)C(F)(F)F)c1cccc2ccccc12
|
Launched
| true |
ACH-001318
|
BRD-K74514084-003-09-2
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.831774 | -0.284558 | 0.025101 | 0.964344 | 0.000417 | null |
pazopanib
|
KIT inhibitor, PDGFR tyrosine kinase receptor inhibitor, VEGFR inhibitor
|
CSF1R, FGF1, FGFR1, FGFR3, FLT1, FLT4, ITK, KDR, KIT, PDGFRA, PDGFRB, SH2B3
|
oncology
|
renal cell carcinoma (RCC), soft tissue sarcoma (STS)
|
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1, CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
|
Launched
| true |
ACH-001318
|
BRD-K75009076-001-02-1
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.37186 | 2.850421 | 0.416908 | 0.824649 | 0.666041 | 1.073855 |
SCH-900776
|
CHK inhibitor
|
CDK2, CHEK1
| null | null |
Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)[C@@H]1CCCNC1, Cn1cc(cn1)-c1cnn2c(N)c(Br)c(nc12)[C@@H]1CCCNC1
|
Phase 2
| true |
ACH-001318
|
BRD-K76210423-001-01-6
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.095707 | -0.655713 | -0.020687 | 1 | 0.005129 | null |
resiquimod
|
toll-like receptor agonist
|
TLR7, TLR8
| null | null |
CCOCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O, CCOCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O
|
Phase 3
| true |
ACH-001318
|
BRD-K76239644-001-02-6
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.537482 | 0.130597 | 0.124394 | 0.765749 | 0.063643 | null |
BMS-690514
|
EGFR inhibitor, VEGFR inhibitor
|
EGFR, ERBB2, FLT3, KDR
| null | null |
COc1cccc(Nc2ncnn3ccc(CN4CC[C@@H](N)[C@H](O)C4)c23)c1, COc1cccc(Nc2ncnn3ccc(CN4CC[C@@H](N)[C@H](O)C4)c23)c1
|
Phase 2
| true |
ACH-001318
|
BRD-K76674262-001-03-3
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.067307 | 0.81876 | 0.779616 | 0.591611 | 0.146235 | 0.174476 |
homoharringtonine
|
protein synthesis inhibitor
|
RPL3
|
hematologic malignancy
|
chronic myeloid leukemia (CML)
|
COC(=O)C[C@](O)(CCCC(C)(C)O)C(=O)O[C@H]1[C@H]2c3cc4OCOc4cc3CCN3CCC[C@]23C=C1OC
|
Launched
| true |
ACH-001318
|
BRD-K76908866-001-07-6
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.657945 | 2.599195 | 0.558892 | 0.841734 | 0.112177 | null |
CP-724714
|
EGFR inhibitor, protein tyrosine kinase inhibitor
|
ERBB2
| null | null |
COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1
|
Phase 2
| true |
ACH-001318
|
BRD-K78431006-001-15-1
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.801265 | -0.020105 | -0.047515 | 0.862936 | 14,365,629,701,232,934 | null |
crizotinib
|
ALK tyrosine kinase receptor inhibitor
|
ALK, MET
|
oncology
|
non-small cell lung cancer (NSCLC)
|
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl, C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl, C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl
|
Launched
| true |
ACH-001318
|
BRD-K79254416-001-21-8
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.754173 | 0.812616 | 0.098039 | 0.970988 | 5.888442 | null |
decitabine
|
DNA methyltransferase inhibitor
|
DNMT1, DNMT3A
|
hematologic malignancy, hematology
|
myelodysplastic diseases (MDS), anemia, chronic myeloid leukemia (CML)
|
Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1, Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1, Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
|
Launched
| true |
ACH-001318
|
BRD-K81016934-001-02-0
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.105607 | 0.012147 | -0.002156 | 1 | 0.000525 | null |
INC-280
|
c-Met inhibitor
|
MET
| null | null |
CNC(=O)c1ccc(cc1F)-c1cnc2ncc(Cc3ccc4ncccc4c3)n2n1
|
Phase 2
| true |
ACH-001318
|
BRD-K81418486-001-44-2
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.05022 | 4.026756 | 0.915906 | 0.849923 | 2.159018 | 2.21648 |
vorinostat
|
HDAC inhibitor
|
HDAC1, HDAC10, HDAC11, HDAC2, HDAC3, HDAC5, HDAC6, HDAC8, HDAC9
|
hematologic malignancy
|
cutaneous T-cell lymphoma (CTCL)
|
ONC(=O)CCCCCCC(=O)Nc1ccccc1, ONC(=O)CCCCCCC(=O)Nc1ccccc1, ONC(=O)CCCCCCC(=O)Nc1ccccc1
|
Launched
| true |
ACH-001318
|
BRD-K81473043-001-19-5
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.12225 | 3.763223 | 0.737359 | 0.781729 | 0.055944 | 0.060272 |
tanespimycin
|
HSP inhibitor
|
HSP90AA1
| null | null |
CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O, CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O
|
Phase 3
| true |
ACH-001318
|
BRD-K82135108-001-04-3
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.486777 | 0.136759 | -0.319944 | 0.78318 | 0.098679 | null |
elesclomol
|
oxidative stress inducer
|
HSPA1A
| null | null |
CN(NC(=O)CC(=O)NN(C)C(=S)c1ccccc1)C(=S)c1ccccc1
|
Phase 3
| true |
ACH-001318
|
BRD-K82746043-001-19-3
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.495508 | 0.352855 | 0.215941 | 0.800021 | 0.337998 | null |
navitoclax
|
BCL inhibitor
|
BCL2, BCL2L1, BCL2L2
| null | null |
CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1, CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
|
Phase 2
| true |
ACH-001318
|
BRD-K82818427-001-04-8
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.576268 | 2.772069 | 0.354491 | 0.88153 | 0.663315 | null |
batimastat
|
matrix metalloprotease inhibitor
|
ADAM28, ADAMTS5, MMP12, MMP16, MMP2, MMP8
| null | null |
CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)[C@H](CSc1cccs1)C(=O)NO, CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)[C@H](CSc1cccs1)C(=O)NO
|
Phase 3
| true |
ACH-001318
|
BRD-K83029223-001-01-3
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.151754 | 1.135113 | 0.720542 | 0.472358 | 0.001474 | 0.002027 |
litronesib
|
kinesin-like spindle protein inhibitor
|
KIF11
| null | null |
CCNCCS(=O)(=O)NC[C@]1(SC(NC(=O)C(C)(C)C)=NN1C(=O)C(C)(C)C)c1ccccc1
|
Phase 2
| true |
ACH-001318
|
BRD-K83988098-001-02-0
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.053744 | 1.053609 | 0.443495 | 0.691099 | 0.006789 | 0.007563 |
alvespimycin
|
HSP inhibitor
|
HSP90AA1
| null | null |
CO[C@H]1C[C@H](C)CC2=C(NCCN(C)C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O, CO[C@H]1C[C@H](C)CC2=C(NCCN(C)C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O
|
Phase 2
| true |
ACH-001318
|
BRD-K85402309-043-01-9
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.292502 | -0.393578 | -0.058785 | 1 | 0.007293 | null |
dovitinib
|
EGFR inhibitor, FGFR inhibitor, FLT3 inhibitor, PDGFR tyrosine kinase receptor inhibitor, VEGFR inhibitor
|
CSF1R, EGFR, FGFR1, FGFR2, FGFR3, FLT1, FLT3, FLT4, INSR, KDR, KIT, PDGFRA, PDGFRB
| null | null |
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O, CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O, CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O, CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O, CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O, CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
|
Phase 3
| true |
ACH-001318
|
BRD-K86118762-001-01-8
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.730695 | 3.372953 | 0.195268 | 0.890443 | 0.192934 | null |
linsitinib
|
IGF-1 inhibitor
|
IGF1R, INSR, INSRR
| null | null |
C[C@@]1(O)C[C@@H](C1)c1nc(-c2ccc3ccc(nc3c2)-c2ccccc2)c2c(N)nccn12, C[C@@]1(O)C[C@@H](C1)c1nc(-c2ccc3ccc(nc3c2)-c2ccccc2)c2c(N)nccn12
|
Phase 3
| true |
ACH-001318
|
BRD-K86972824-001-01-4
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.695918 | 0.22583 | -0.013666 | 0.89607 | 1.871502 | null |
oltipraz
|
nuclear factor erythroid derived, like (NRF2) activator
|
ANG
| null | null |
Cc1c(ssc1=S)-c1cnccn1, Cc1c(ssc1=S)-c1cnccn1
|
Phase 3
| true |
ACH-001318
|
BRD-K87737963-001-06-0
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.01456 | 0.141735 | -0.039052 | 1 | 0.011922 | null |
cyt387
| null |
JAK1, JAK2, JAK3
| null | null |
O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1, O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
|
Phase 3
| true |
ACH-001318
|
BRD-K87782578-001-01-4
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.135367 | 0.15294 | -0.099373 | 1 | 0.115992 | null |
AVL-292
|
Bruton's tyrosine kinase (BTK) inhibitor
|
BTK, YES1
| null | null |
COCCOc1ccc(Nc2ncc(F)c(Nc3cccc(NC(=O)C=C)c3)n2)cc1
|
Phase 2
| true |
ACH-001318
|
BRD-K87909389-003-03-4
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.133955 | 9.218079 | 0.749516 | 0.821942 | 0.452055 | 0.46761 |
alvocidib
|
CDK inhibitor
|
CDK1, CDK2, CDK4, CDK5, CDK6, CDK7, CDK8, CDK9, EGFR, PYGM
| null | null |
CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl, CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl
|
Phase 2
| true |
ACH-001318
|
BRD-K88510285-001-17-8
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.175215 | 0.565799 | 0.702671 | 0.628789 | 0.033965 | 0.072811 |
bortezomib
|
NFkB pathway inhibitor, proteasome inhibitor
|
PSMA1, PSMA2, PSMA3, PSMA4, PSMA5, PSMA6, PSMA7, PSMA8, PSMB1, PSMB10, PSMB11, PSMB2, PSMB3, PSMB4, PSMB5, PSMB6, PSMB7, PSMB8, PSMB9, PSMD1, PSMD2, RELA
|
hematologic malignancy
|
multiple myeloma, mantle cell lymphoma (MCL)
|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O, CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O, CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O, CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O, CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
|
Launched
| true |
ACH-001318
|
BRD-K89014967-001-04-3
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.172004 | -1.698007 | 0.217591 | 0.963616 | 0.000632 | null |
AS-703026
|
MEK inhibitor
|
MAP2K1, MAP2K2
| null | null |
OC[C@@H](O)CNC(=O)c1ccncc1Nc1ccc(I)cc1F
|
Phase 2
| true |
ACH-001318
|
BRD-K92441787-001-04-1
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.745337 | -0.230439 | -0.016632 | 0.86528 | 0.136126 | null |
bexarotene
|
retinoid receptor agonist
|
RXRA, RXRB, RXRG
|
hematologic malignancy
|
cutaneous T-cell lymphoma (CTCL)
|
Cc1cc2c(cc1C(=C)c1ccc(cc1)C(O)=O)C(C)(C)CCC2(C)C
|
Launched
| true |
ACH-001318
|
BRD-K92723993-001-17-4
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.785412 | 0.338677 | 0.00808 | 0.910309 | 0.255782 | null |
imatinib
|
Bcr-Abl kinase inhibitor, KIT inhibitor, PDGFR tyrosine kinase receptor inhibitor
|
ABL1, CSF1R, DDR1, KIT, NTRK1, PDGFRA, PDGFRB, RET
|
hematologic malignancy, oncology
|
chronic myeloid leukemia (CML), acute lymphoblastic leukemia (ALL), myelodysplastic diseases (MDS), aggressive systemic mastocytosis (ASM), hypereosinophilic syndrome (HES), chronic eosinophilic leukemia (CEL), dermatofibrosarcoma protuberans (DFSP), gastrointestinal stromal tumors (GIST)
|
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1, CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1, CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
|
Launched
| true |
ACH-001318
|
BRD-K95142244-001-01-5
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.930697 | -0.696 | -0.089081 | 0.965382 | 0.077712 | null |
talazoparib
|
PARP inhibitor
|
PARP2
| null | null |
Cn1ncnc1[C@@H]1[C@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(F)cc1
|
Phase 3
| true |
ACH-001318
|
BRD-K96123349-236-02-8
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.190457 | 0.110718 | -0.004785 | 1 | 0.027325 | null |
brequinar
|
dihydroorotate dehydrogenase inhibitor
|
DHODH
| null | null |
Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F
|
Phase 2
| true |
ACH-001318
|
BRD-K98572433-001-02-9
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.884883 | 4.478062 | 0.213548 | 0.91769 | 0.009693 | null |
AZD8931
|
EGFR inhibitor
|
EGFR, ERBB2, ERBB3
| null | null |
CNC(=O)CN1CCC(CC1)Oc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC
|
Phase 2
| true |
ACH-001318
|
BRD-K99113996-001-02-0
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.417734 | 1.014838 | 0.67069 | 0.725063 | 0.102716 | 0.608041 |
AZD2014
|
mTOR inhibitor
|
MTOR
| null | null |
CNC(=O)c1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C
|
Phase 2
| true |
ACH-001318
|
BRD-K99616396-001-05-1
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.661917 | 0.200289 | 0.038528 | 0.795886 | 0.008128 | null |
motesanib
|
KIT inhibitor, PDGFR tyrosine kinase receptor inhibitor, VEGFR inhibitor
|
FLT1, FLT4, KDR, KIT
| null | null |
CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12, CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12, CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12, CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12, CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc12
|
Phase 3
| true |
ACH-001318
|
BRD-K99749624-001-07-0
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 0.82234 | -0.164478 | -0.059048 | 0.898876 | 0.464138 | null |
linifanib
|
PDGFR tyrosine kinase receptor inhibitor, VEGFR inhibitor
|
CSF1, CSF1R, FLT1, FLT3, FLT4, KDR, KIT, PDGFRB, RET, TEK
| null | null |
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
|
Phase 3
| true |
ACH-001318
|
BRD-M97302542-001-04-4
|
ACH-001318
|
PLCPRF5_LIVER
|
MTS010
| 1 | 1.124633 | 0.241014 | -0.048317 | 1 | 0.002991 | null |
dichloroacetate
|
pyruvate dehydrogenase kinase inhibitor
|
PDK1
| null | null |
[Na].OC(=O)C(Cl)Cl, [Na].OC(=O)C(Cl)Cl
|
Phase 3
| true |
ACH-001318
|
BRD-A25234499-001-19-1
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.80084 | 4.333012 | 0.280078 | 0.90582 | 0.101609 | null |
aminoglutethimide
|
glucocorticoid receptor antagonist
|
CYP11A1, CYP19A1
|
endocrinology, oncology
|
Cushing's syndrome, breast cancer
|
CCC1(CCC(=O)NC1=O)c1ccc(N)cc1, CCC1(CCC(=O)NC1=O)c1ccc(N)cc1, CCC1(CCC(=O)NC1=O)c1ccc(N)cc1
|
Launched
| true |
ACH-001321
|
BRD-A70858459-001-01-7
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.768624 | -5.713003 | 0.166676 | 0.883909 | 0.079433 | null |
estramustine
|
DNA alkylating agent
|
ESR1, ESR2, MAP1A, MAP2
|
oncology
|
prostate cancer
|
C[C@]12CCC3C(CCc4cc(OC(=O)N(CCCl)CCCl)ccc34)C1CC[C@@H]2O
|
Launched
| true |
ACH-001321
|
BRD-A74914197-001-02-9
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 3.085992 | 0.513684 | 0.181069 | 1 | 0.24501 | null |
pralatrexate
|
dihydrofolate reductase inhibitor
|
DHFR, TYMS
|
hematologic malignancy
|
peripheral T-cell lymphoma (PTCL)
|
Nc1nc(N)c2nc(CC(CC#C)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2n1
|
Launched
| true |
ACH-001321
|
BRD-K02113016-001-19-6
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.992868 | -0.078448 | -0.038199 | 0.996433 | 0.078974 | null |
olaparib
|
PARP inhibitor
|
PARP1, PARP2
|
oncology
|
ovarian cancer
|
Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)C(=O)C1CC1, Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)C(=O)C1CC1
|
Launched
| true |
ACH-001321
|
BRD-K02130563-001-11-4
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.155405 | 0.489118 | 0.841853 | 0.410905 | 0.007114 | 0.015227 |
panobinostat
|
HDAC inhibitor
|
HDAC1, HDAC2, HDAC3, HDAC4, HDAC6, HDAC7, HDAC8, HDAC9
|
hematologic malignancy
|
multiple myeloma
|
Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1, Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1, Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1, Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1
|
Launched
| true |
ACH-001321
|
BRD-K03390685-001-01-7
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 4.65528 | 7.903625 | 0.823589 | 1 | 0.627629 | null |
cobimetinib
|
MEK inhibitor
| null |
oncology
|
melanoma
|
OC1(CN(C1)C(=O)c1ccc(F)c(F)c1Nc1ccc(I)cc1F)[C@@H]1CCCCN1
|
Launched
| true |
ACH-001321
|
BRD-K03406345-001-21-1
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 2.968504 | 3.224055 | 0.962461 | 1 | 3.461772 | null |
azacitidine
|
DNA methyltransferase inhibitor
|
DNMT1, DNMT3A
|
hematologic malignancy, hematology
|
myelodysplastic diseases (MDS), anemia, chronic myelomonocytic leukemia (CMMoL)
|
Nc1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1, Nc1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1, Nc1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
|
Launched
| true |
ACH-001321
|
BRD-K03449891-001-08-6
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.818449 | -1.985101 | 0.054831 | 0.908037 | 0.041236 | null |
foretinib
|
VEGFR inhibitor
|
FLT1, FLT4, KDR, MET
| null | null |
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCOCC1
|
Phase 2
| true |
ACH-001321
|
BRD-K03765900-001-01-9
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.83385 | -0.387301 | -0.100559 | 0.924023 | 0.044386 | null |
XL-647
|
EGFR inhibitor, VEGFR inhibitor
|
EGFR, EPHB4, ERBB2, FLT4, KDR
| null | null |
COc1cc2c(Nc3ccc(Cl)c(Cl)c3F)ncnc2cc1OC[C@H]1C[C@H]2CN(C)C[C@H]2C1
|
Phase 3
| true |
ACH-001321
|
BRD-K05804044-001-18-5
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 1.432358 | 1.164802 | 0.172558 | 1 | 2.66488 | null |
AZ-628
|
RAF inhibitor
|
BRAF, RAF1
| null | null |
Cc1ccc(NC(=O)c2cccc(c2)C(C)(C)C#N)cc1Nc1ccc2ncn(C)c(=O)c2c1, Cc1ccc(NC(=O)c2cccc(c2)C(C)(C)C#N)cc1Nc1ccc2ncn(C)c(=O)c2c1, Cc1ccc(NC(=O)c2cccc(c2)C(C)(C)C#N)cc1Nc1ccc2ncn(C)c(=O)c2c1, Cc1ccc(NC(=O)c2cccc(c2)C(C)(C)C#N)cc1Nc1ccc2ncn(C)c(=O)c2c1
|
Preclinical
| true |
ACH-001321
|
BRD-K06814349-304-02-7
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.863063 | -0.102187 | -0.071501 | 0.902809 | 582.941921 | null |
fosbretabulin
|
tubulin polymerization inhibitor, VE-cadherin antagonist
|
CDH5
| null | null |
COc1ccc(C=Cc2cc(OC)c(OC)c(OC)c2)cc1OP(O)(O)=O, COc1ccc(cc1OP(O)(O)=O)\C=C/c1cc(OC)c(OC)c(OC)c1, COc1ccc(cc1OP(O)(O)=O)\C=C/c1cc(OC)c(OC)c(OC)c1, COc1ccc(C=Cc2cc(OC)c(OC)c(OC)c2)cc1OP(O)(O)=O
|
Phase 3
| true |
ACH-001321
|
BRD-K08109215-001-06-4
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.648922 | 3.253831 | 0.74558 | 0.795408 | 0.034985 | null |
I-BET-762
|
bromodomain inhibitor
|
BRD2, BRD3, BRD4
| null | null |
CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12
|
Phase 2
| true |
ACH-001321
|
BRD-K08542803-001-02-3
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.225141 | 2.38783 | 0.750759 | 0.69809 | 0.227956 | 0.292873 |
gambogic-acid
|
caspase activator
|
BCL2
| null | null |
CC(C)=CCC[C@@]1(C)Oc2c(CC=C(C)C)c3O[C@@]45[C@H]6C[C@@H](C=C4C(=O)c3c(O)c2C=C1)C(=O)[C@]5(C\C=C(\C)C(O)=O)OC6(C)C, CC(C)=CCC[C@@]1(C)Oc2c(CC=C(C)C)c3O[C@@]45[C@H]6C[C@@H](C=C4C(=O)c3c(O)c2C=C1)C(=O)[C@]5(C\C=C(\C)C(O)=O)OC6(C)C, CC(C)=CCC[C@@]1(C)Oc2c(CC=C(C)C)c3O[C@@]45[C@H]6C[C@@H](C=C4C(=O)c3c(O)c2C=C1)C(=O)[C@]5(C\C=C(\C)C(O)=O)OC6(C)C
|
Phase 2
| true |
ACH-001321
|
BRD-K08547377-001-04-4
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.331416 | 0.400317 | 0.173218 | 0.677113 | 0.09742 | 1.472626 |
irinotecan
|
topoisomerase inhibitor
|
TOP1, TOP1MT
|
oncology
|
colorectal cancer
|
CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12, CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12
|
Launched
| true |
ACH-001321
|
BRD-K08703257-001-13-9
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.92127 | 0.408475 | -0.027673 | 0.956463 | 0.039548 | null |
3-amino-benzamide
|
PARP inhibitor
|
PARP1
| null | null |
NC(=O)c1cccc(N)c1, NC(=O)c1cccc(N)c1
|
Phase 2
| true |
ACH-001321
|
BRD-K09951645-001-11-8
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.668192 | 1.184956 | 0.282626 | 0.718498 | 0.002259 | null |
dabrafenib
|
RAF inhibitor
|
BRAF, LIMK1, NEK11, RAF1, SIK1
|
oncology
|
melanoma
|
CC(C)(C)c1nc(c(s1)-c1ccnc(N)n1)-c1cccc(NS(=O)(=O)c2c(F)cccc2F)c1F, CC(C)(C)c1nc(c(s1)-c1ccnc(N)n1)-c1cccc(NS(=O)(=O)c2c(F)cccc2F)c1F, CC(C)(C)c1nc(c(s1)-c1ccnc(N)n1)-c1cccc(NS(=O)(=O)c2c(F)cccc2F)c1F
|
Launched
| true |
ACH-001321
|
BRD-K11630072-001-13-2
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.859239 | -2.970701 | -0.254053 | 0.933209 | 0.060979 | null |
carmofur
|
thymidylate synthase inhibitor
|
TYMS
|
oncology
|
breast cancer, colorectal cancer
|
CCCCCCNC(=O)n1cc(F)c(=O)[nH]c1=O, CCCCCCNC(=O)n1cc(F)c(=O)[nH]c1=O, CCCCCCNC(=O)n1cc(F)c(=O)[nH]c1=O
|
Launched
| true |
ACH-001321
|
BRD-K12184916-001-19-6
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 3.637481 | 0.233557 | 0.112671 | 1 | 1.751777 | null |
NVP-BEZ235
|
mTOR inhibitor, PI3K inhibitor
|
ATR, MTOR, PIK3CA, PIK3CD, PIK3CG
| null | null |
Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1cnc2ccccc2c1, Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1cnc2ccccc2c1
|
Phase 2
| true |
ACH-001321
|
BRD-K12343256-001-14-7
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 3.197648 | 0.707876 | 0.609291 | 1 | 0.10767 | null |
trametinib
|
MEK inhibitor
|
MAP2K1, MAP2K2
|
oncology
|
melanoma
|
CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O, CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O, CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O, CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O
|
Launched
| true |
ACH-001321
|
BRD-K13049116-001-04-0
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.928195 | 0.188543 | -0.067336 | 0.96394 | 0.074318 | null |
BMS-754807
|
IGF-1 inhibitor
|
AKT1, IGF1R
| null | null |
C[C@]1(CCCN1c1nc(Nc2cc(n[nH]2)C2CC2)c2cccn2n1)C(=O)Nc1ccc(F)nc1, C[C@]1(CCCN1c1nc(Nc2cc(n[nH]2)C2CC2)c2cccn2n1)C(=O)Nc1ccc(F)nc1, C[C@]1(CCCN1c1nc(Nc2cc(n[nH]2)C2CC2)c2cccn2n1)C(=O)Nc1ccc(F)nc1
|
Phase 2
| true |
ACH-001321
|
BRD-K13390322-001-06-3
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 1.578234 | 4.039253 | 0.273297 | 1 | 1.430652 | null |
AT-7519
|
CDK inhibitor
|
CDK1, CDK2, CDK4, CDK5, CDK6, CDK9
| null | null |
Clc1cccc(Cl)c1C(=O)Nc1c[nH]nc1C(=O)NC1CCNCC1
|
Phase 2
| true |
ACH-001321
|
BRD-K13514097-001-04-6
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 3.256663 | 0.066125 | 0.119268 | 1 | 0.085895 | null |
everolimus
|
mTOR inhibitor
|
MTOR
|
oncology, neurology/psychiatry, genetics, urology
|
breast cancer, neuroendocrine tumors of pancreatic origin (PNET), renal cell carcinoma (RCC), subependymal giant cell astrocytoma (SEGA), tuberous sclerosis complex (TSC), renal angiomyolipoma
|
CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1OCCO, CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1OCCO
|
Launched
| true |
ACH-001321
|
BRD-K13662825-001-07-5
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.970445 | -0.163041 | -0.054779 | 0.974845 | 1,340.938468 | null |
dinaciclib
|
CDK inhibitor
|
CDK1, CDK2, CDK5, CDK9
| null | null |
CCc1cnn2c(NCc3ccc[n+]([O-])c3)cc(nc12)N1CCCC[C@H]1CCO
|
Phase 3
| true |
ACH-001321
|
BRD-K14109347-001-03-4
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 2.183478 | 2.063946 | 0.605891 | 1 | 0.623457 | null |
LY2603618
|
CHK inhibitor
|
CHEK1
| null | null |
Cc1cnc(NC(=O)Nc2cc(Br)c(C)cc2OC[C@@H]2CNCCO2)cn1, Cc1cnc(NC(=O)Nc2cc(Br)c(C)cc2OC[C@@H]2CNCCO2)cn1
|
Phase 2
| true |
ACH-001321
|
BRD-K15179879-001-03-2
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.379729 | 2.982659 | 0.741257 | 0.458009 | 0.002058 | 0.003318 |
carfilzomib
|
proteasome inhibitor
|
PSMA1, PSMA2, PSMA3, PSMA4, PSMA5, PSMA6, PSMA7, PSMA8, PSMB1, PSMB10, PSMB11, PSMB2, PSMB3, PSMB4, PSMB5, PSMB6, PSMB7, PSMB8, PSMB9
|
hematologic malignancy
|
multiple myeloma
|
CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)NC(=O)CN1CCOCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)[C@@]1(C)CO1
|
Launched
| true |
ACH-001321
|
BRD-K15600710-066-05-8
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 2.410712 | 0.039003 | -0.088445 | 1 | 32,697,026,043,450,080,000 | null |
obatoclax
|
BCL inhibitor
|
BCL2
| null | null |
COC1=CC(=N\C\1=C/c1[nH]c(C)cc1C)c1cc2ccccc2[nH]1, COC1=CC(=N\C\1=C/c1[nH]c(C)cc1C)c1cc2ccccc2[nH]1
|
Phase 3
| true |
ACH-001321
|
BRD-K16730910-001-10-7
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.652809 | 1.68208 | 0.089401 | 0.743112 | 0.007548 | null |
regorafenib
|
FGFR inhibitor, KIT inhibitor, PDGFR tyrosine kinase receptor inhibitor, RAF inhibitor, RET tyrosine kinase inhibitor, VEGFR inhibitor
|
ABL1, BRAF, DDR2, EPHA2, FGFR1, FGFR2, FLT1, FLT4, FRK, KDR, KIT, MAPK11, NTRK1, PDGFRA, PDGFRB, RAF1, RET, TEK
|
oncology
|
colorectal cancer, gastrointestinal stromal tumors (GIST)
|
CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)c(F)c2)ccn1
|
Launched
| true |
ACH-001321
|
BRD-K17555800-003-02-3
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | -0.592209 | -1.857123 | 0.562964 | 0.966611 | 0.000401 | 0.000611 |
talmapimod
|
p38 MAPK inhibitor
|
MAPK11, MAPK14
| null | null |
C[C@H]1CN([C@H](C)CN1Cc1ccc(F)cc1)C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C, C[C@H]1CN([C@H](C)CN1Cc1ccc(F)cc1)C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C, C[C@H]1CN([C@H](C)CN1Cc1ccc(F)cc1)C(=O)c1cc2c(cn(C)c2cc1Cl)C(=O)C(=O)N(C)C
|
Phase 2
| true |
ACH-001321
|
BRD-K17610631-001-03-3
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.560349 | -1.49748 | -0.122518 | 0.961704 | 0.001103 | null |
indisulam
|
CDK inhibitor
|
CA1, CA12, CA14, CA2, CA6, CA7, CA9
| null | null |
NS(=O)(=O)c1ccc(cc1)S(=O)(=O)Nc1cccc2c(Cl)c[nH]c12
|
Phase 2
| true |
ACH-001321
|
BRD-K17743125-001-08-4
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.183703 | 3.813499 | 0.903888 | 0.773007 | 0.672978 | 0.758857 |
belinostat
|
HDAC inhibitor
|
HDAC1, HDAC10, HDAC11, HDAC2, HDAC3, HDAC4, HDAC5, HDAC6, HDAC7, HDAC8, HDAC9
|
hematologic malignancy
|
peripheral T-cell lymphoma (PTCL)
|
ONC(=O)\C=C\c1cccc(c1)S(=O)(=O)Nc1ccccc1
|
Launched
| true |
ACH-001321
|
BRD-K17894950-001-14-3
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 1.076734 | -0.273559 | -0.024894 | 1 | 0.003645 | null |
indirubin
|
CDK inhibitor, glycogen synthase kinase inhibitor
|
CDK1, CDK5, GSK3A
| null | null |
O=C1Nc2ccccc2\C1=C1\Nc2ccccc2C1=O
|
Phase 2/Phase 3
| true |
ACH-001321
|
BRD-K18961567-001-01-1
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.918812 | -2.457927 | -0.221168 | 0.954514 | 0.140169 | null |
LY2801653
|
MET inhibitor
|
MET
| null | null |
Cc1ccc(C(=O)Nc2ccc(Oc3cc4cnn(C)c4cc3-c3cn[nH]c3)c(F)c2)c(=O)n1-c1ccc(F)cc1
|
Phase 2
| true |
ACH-001321
|
BRD-K19540840-001-09-4
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 1.928269 | 0.882373 | 0.472578 | 1 | 2.088952 | null |
saracatinib
|
src inhibitor
|
ABL1, LCK, SRC, YES1
| null | null |
CN1CCN(CCOc2cc(OC3CCOCC3)c3c(Nc4c5OCOc5ccc4Cl)ncnc3c2)CC1
|
Phase 2/Phase 3
| true |
ACH-001321
|
BRD-K19687926-001-04-1
|
ACH-001321
|
TT_THYROID
|
MTS010
| 1 | 0.809493 | -1.260812 | -0.058398 | 0.978085 | 0.001491 | null |
lapatinib
|
EGFR inhibitor
|
EGFR, ERBB2
|
oncology
|
breast cancer
|
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1, CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1, CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
|
Launched
| true |
ACH-001321
|
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