iGMDRD568


Canonical SMILES: CC1(CCC(=C(C1)CN2CCN(CC2)C3=CC=C(C=C3)C(=O)NS(=O)(=O)C4=CC(=C(C=C4)NC(CCN5CCOCC5)CSC6=CC=CC=C6)S(=O)(=O)C(F)(F)F)C7=CC=C(C=C7)Cl)C

InChI: InChI=1S/C47H55ClF3N5O6S3/c1-46(2)20-18-42(34-8-12-37(48)13-9-34)36(31-46)32-55-22-24-56(25-23-55)39-14-10-35(11-15-39)45(57)53-65(60,61)41-16-17-43(44(30-41)64(58,59)47(49,50)51)52-38(19-21-54-26-28-62-29-27-54)33-63-40-6-4-3-5-7-40/h3-17,30,38,52H,18-29,31-33H2,1-2H3,(H,53,57)

InChI Key: JLYAXFNOILIKPP-UHFFFAOYSA-N

Standard NamePubchem CIDDrug StatusDrug Type
SCHEMBL1500551225059300AloneSmall Molecule

Drug Targets:

BCL2BCL2L1BCL2L2

Drug Pathways:

Apoptosis regulation

Drug-model tissue-cancer distribution: Bubble Plot

Drug-gene pathway enrichments

Drug-gene GO enrichments

Drug-Gene: Aster Plot


Gene IDGene NameModel Num.
8289ARID1A1
1387CREBBP1
4851NOTCH11
7428VHL1
1029CDKN2A1
7157TP531
2322FLT31
8731RNMT2
79987SVEP11
64919BCL11B1
596BCL21
598BCL2L11
53335BCL11A1
5925RB11
4763NF11
4613MYCN1
6662SOX91

Gene in drug-gene network: Network Plot

Models in SCHEMBL15005512

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