Reaction Details Report a problem with these data
Target
Bcl2-associated agonist of cell death
Ligand
BDBM50274325
Substrate
n/a
Meas. Tech.
ChEMBL_537289 (CHEMBL985385)
Ki
1.4±n/a nM
Citation
 Park, CM; Bruncko, M; Adickes, J; Bauch, J; Ding, H; Kunzer, A; Marsh, KC; Nimmer, P; Shoemaker, AR; Song, X; Tahir, SK; Tse, C; Wang, X; Wendt, MD; Yang, X; Zhang, H; Fesik, SW; Rosenberg, SH; Elmore, SW Discovery of an orally bioavailable small molecule inhibitor of prosurvival B-cell lymphoma 2 proteins. J Med Chem 51:6902-15 (2008) [PubMed]  Article 
Target
Name:
Bcl2-associated agonist of cell death
Synonyms:
BAD | BAD_HUMAN | BBC6 | BCL2L8 | Bcl-2-binding component 6 | Bcl-2-like protein 8 | Bcl-XL/Bcl-2-associated death promoter | Bcl2 antagonist of cell death | Bcl2-L-8 | Bcl2-antagonist of cell death (BAD)
Type:
PROTEIN
Mol. Mass.:
18393.69
Organism:
Homo sapiens (Human)
Description:
ChEMBL_478760
Residue:
168
Sequence:
MFQIPEFEPSEQEDSSSAERGLGPSPAGDGPSGSGKHHRQAPGLLWDASHQQEQPTSSSHHGGAGAVEIRSRHSSYPAGTEDDEGMGEEPSPFRGRSRSAPPNLWAAQRYGRELRRMSDEFVDSFKKGLPRPKSAGTATQMRQSSSWTRVFQSWWDRNLGRGSSAPSQ
  
Inhibitor
Name:
BDBM50274325
Synonyms:
(R)-4-(4-((2-(4-Chlorophenyl)-5,5-dimethylcyclohex-1-enyl)methyl)piperazin-1-yl)-N-(4-(4-(dimethylamino)-1-(phenylthio)butan-2-ylamino)-3-nitrophenylsulfonyl)benzamide | CHEMBL448740
Type:
Small organic molecule
Emp. Form.:
C44H53ClN6O5S2
Mol. Mass.:
845.512
SMILES:
CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(CC2=C(CCC(C)(C)C2)c2ccc(Cl)cc2)CC1 |r,t:44|
Structure:
Search PDB for entries with ligand similarity: