Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Apoptosis regulator Bcl-2' and Ligand = 'BDBM179584'   

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
Apoptosis regulator Bcl-2 (Homo sapiens (Human))	BDBM179584 (US9126980, 29) Show SMILES CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1ccc(NS(=O)CCc2cccc3ccccc23)cc1C(=O)N1Cc2ccccc2C[C@H]1CO |r| Show InChI InChI=1S/C42H49N5O4S/c1-4-6-22-45(23-7-5-2)42(50)39-25-30(3)47(43-39)40-20-19-35(44-52(51)24-21-32-17-12-16-31-13-10-11-18-37(31)32)27-38(40)41(49)46-28-34-15-9-8-14-33(34)26-36(46)29-48/h8-20,25,27,36,44,48H,4-7,21-24,26,28-29H2,1-3H3/t36-,52?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	529	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Methods for Determining IC50s.The present method includes utility of a Surface plasmon resonance (SPR)- based biosensor (Biacore GE Healthcare, Uppsa...				US Patent US9126980 (2015) BindingDB Entry DOI: 10.7270/Q2S18184
					More data for this Ligand-Target Pair
Apoptosis regulator Bcl-2 (Homo sapiens (Human))	BDBM179584 (US9126980, 29) Show SMILES CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1ccc(NS(=O)CCc2cccc3ccccc23)cc1C(=O)N1Cc2ccccc2C[C@H]1CO |r| Show InChI InChI=1S/C42H49N5O4S/c1-4-6-22-45(23-7-5-2)42(50)39-25-30(3)47(43-39)40-20-19-35(44-52(51)24-21-32-17-12-16-31-13-10-11-18-37(31)32)27-38(40)41(49)46-28-34-15-9-8-14-33(34)26-36(46)29-48/h8-20,25,27,36,44,48H,4-7,21-24,26,28-29H2,1-3H3/t36-,52?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	709	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Methods for Determining IC50s.The present method includes utility of a Surface plasmon resonance (SPR)- based biosensor (Biacore GE Healthcare, Uppsa...				US Patent US9126980 (2015) BindingDB Entry DOI: 10.7270/Q2S18184
					More data for this Ligand-Target Pair