Reaction Details Report a problem with these data
Target
Apoptosis regulator Bcl-2
Ligand
BDBM21411
Substrate
Fluorescein-labeled BAX peptide
Meas. Tech.
Fluorescence Polarization Assay and FL5.12 Cellular Assay
Ki
16±n/a nM
EC50
1000±n/a nM
Citation
 Bruncko, M; Oost, TK; Belli, BA; Ding, H; Joseph, MK; Kunzer, A; Martineau, D; McClellan, WJ; Mitten, M; Ng, SC; Nimmer, PM; Oltersdorf, T; Park, CM; Petros, AM; Shoemaker, AR; Song, X; Wang, X; Wendt, MD; Zhang, H; Fesik, SW; Rosenberg, SH; Elmore, SW Studies leading to potent, dual inhibitors of Bcl-2 and Bcl-xL. J Med Chem 50:641-62 (2007) [PubMed]  Article 
Target
Name:
Apoptosis regulator Bcl-2
Synonyms:
Apoptosis regulator Bcl-2 Protein | B-cell lymphoma 2 protein (Bcl-2) | BCL-2 | BCL2 | BCL2_HUMAN | Bcl-2 Protein
Type:
Homodimer or heterodimer
Mol. Mass.:
26269.11
Organism:
Homo sapiens (Human)
Description:
P10415
Residue:
239
Sequence:
MAHAGRTGYDNREIVMKYIHYKLSQRGYEWDAGDVGAAPPGAAPAPGIFSSQPGHTPHPAASRDPVARTSPLQTPAAPGAAAGPALSPVPPVVHLTLRQAGDDFSRRYRRDFAEMSSQLHLTPFTARGRFATVVEELFRDGVNWGRIVAFFEFGGVMCVESVNREMSPLVDNIALWMTEYLNRHLHTWIQDNGGWDAFVELYGPSMRPLFDFSWLSLKTLLSLALVGACITLGAYLGHK
  
Inhibitor
Name:
BDBM21411
Synonyms:
4-Alkyl-4-methoxypiperidine derivative, 8b | N-[(4-{[(2R)-4-(dimethylamino)-1-(phenylsulfanyl)butan-2-yl]amino}-3-nitrobenzene)sulfonyl]-4-[4-(2,2-dimethylpropyl)-4-methoxypiperidin-1-yl]benzamide
Type:
Small organic molecule
Emp. Form.:
C36H49N5O6S2
Mol. Mass.:
711.934
SMILES:
COC1(CC(C)(C)C)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(N[C@H](CCN(C)C)CSc2ccccc2)c(c1)[N+]([O-])=O |r|
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
Fluorescein-labeled BAX peptide
Synonyms:
n/a
Type:
fluorescein-labeled probe
Mol. Mass.:
2800.15
Organism:
n/a
Description:
n/a
Residue:
25
Sequence:
FITCQDASTKKLSECLKRIGDELDS