Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Bcl-2-related protein A1' and Ligand = 'BDBM50397586'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Bcl-2-related protein A1 (Homo sapiens (Human))	BDBM50397586 (CHEMBL2171488) Show SMILES CCOc1ccc2c(cc(cc2n1)-c1cc2ccccc2nc1N1CCCC1)C(C)C Show InChI InChI=1S/C27H29N3O/c1-4-31-26-12-11-21-22(18(2)3)16-20(17-25(21)28-26)23-15-19-9-5-6-10-24(19)29-27(23)30-13-7-8-14-30/h5-6,9-12,15-18H,4,7-8,13-14H2,1-3H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.55E+4	n/a	n/a	n/a	n/a
Clermont Universit£ Curated by ChEMBL					Assay Description Inhibition of GST-tagged recombinant Bfl1 interaction with biotinylated Bim peptide by ELISA based competitive binding assay				Eur J Med Chem 57: 112-25 (2012) Article DOI: 10.1016/j.ejmech.2012.09.012 BindingDB Entry DOI: 10.7270/Q2B8598P
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