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Target
Bcl-2-like protein 1
Ligand
BDBM50384328
Substrate
n/a
Meas. Tech.
ChEMBL_818166 (CHEMBL2033943)
IC50
120±n/a nM
Citation
 Schroeder, GM; Wei, D; Banfi, P; Cai, ZW; Lippy, J; Menichincheri, M; Modugno, M; Naglich, J; Penhallow, B; Perez, HL; Sack, J; Schmidt, RJ; Tebben, A; Yan, C; Zhang, L; Galvani, A; Lombardo, LJ; Borzilleri, RM Pyrazole and pyrimidine phenylacylsulfonamides as dual Bcl-2/Bcl-xL antagonists. Bioorg Med Chem Lett 22:3951-6 (2012) [PubMed]  Article 
Target
Name:
Bcl-2-like protein 1
Synonyms:
Anti-apoptotic Bcl-2 protein | Apoptosis Regulator Bcl-xL | Apoptosis regulator Bcl-X | B2CL1_HUMAN | BCL2-like 1 isoform 1 | BCL2L | BCL2L1 | BCLX | Bcl-2-like protein 1 (Bcl-XL) | Bcl-X | Bcl-xL/Bcl-2-binding component 3 | Bcl2-L-1 | Bcl2-antagonist of cell death (BAD)
Type:
Mitochondrion membrane; Single-pass membrane protein
Mol. Mass.:
26039.60
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
233
Sequence:
MSQSNRELVVDFLSYKLSQKGYSWSQFSDVEENRTEAPEGTESEMETPSAINGNPSWHLADSPAVNGATGHSSSLDAREVIPMAAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQERFNRWFLTGMTVAGVVLLGSLFSRK
  
Inhibitor
Name:
BDBM50384328
Synonyms:
CHEMBL2030863
Type:
Small organic molecule
Emp. Form.:
C42H45ClN4O6S
Mol. Mass.:
769.348
SMILES:
CCCCCS(=O)(=O)NC(=O)c1ccc(-c2c(CO)nn(c2CCCC)-c2ccc(Oc3cccc(Cl)c3)cc2)c(c1)C(=O)N1CCc2ccccc2C1 |(32.41,-13.03,;32.45,-11.49,;31.13,-10.69,;31.17,-9.15,;29.85,-8.35,;29.89,-6.8,;30.69,-5.48,;31.43,-6.83,;28.58,-6,;28.63,-4.46,;29.98,-3.73,;27.32,-3.65,;27.36,-2.11,;26.04,-1.3,;24.69,-2.04,;23.37,-1.23,;23.25,.3,;24.42,1.3,;24.14,2.82,;21.75,.66,;20.95,-.65,;21.95,-1.82,;20.57,-2.53,;20.49,-4.06,;19.11,-4.76,;17.82,-3.92,;19.41,-.67,;18.63,.66,;17.09,.65,;16.33,-.69,;14.79,-.7,;14.01,.62,;12.47,.6,;11.7,1.92,;12.44,3.27,;13.98,3.28,;14.74,4.63,;14.76,1.96,;17.12,-2.02,;18.66,-2,;24.65,-3.57,;25.96,-4.38,;23.29,-4.31,;21.98,-3.5,;23.25,-5.84,;21.9,-6.58,;21.85,-8.11,;23.16,-8.92,;23.11,-10.45,;24.41,-11.27,;25.77,-10.54,;25.82,-9,;24.52,-8.19,;24.57,-6.65,)|
Structure:
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