Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Apoptosis regulator Bcl-2' and Ligand = 'BDBM179592'   

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))	BDBM179592 (US9126980, 37) Show SMILES CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1ccc(NS(=O)c2ccc(Oc3ccc(C)cc3)cc2)cc1C(=O)N1Cc2ccccc2C[C@H]1CO |r| Show InChI InChI=1S/C43H49N5O5S/c1-5-7-23-46(24-8-6-2)43(51)40-25-31(4)48(44-40)41-22-15-34(27-39(41)42(50)47-28-33-12-10-9-11-32(33)26-35(47)29-49)45-54(52)38-20-18-37(19-21-38)53-36-16-13-30(3)14-17-36/h9-22,25,27,35,45,49H,5-8,23-24,26,28-29H2,1-4H3/t35-,54?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.60E+4	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))	BDBM179592 (US9126980, 37) Show SMILES CCCCN(CCCC)C(=O)c1cc(C)n(n1)-c1ccc(NS(=O)c2ccc(Oc3ccc(C)cc3)cc2)cc1C(=O)N1Cc2ccccc2C[C@H]1CO |r| Show InChI InChI=1S/C43H49N5O5S/c1-5-7-23-46(24-8-6-2)43(51)40-25-31(4)48(44-40)41-22-15-34(27-39(41)42(50)47-28-33-12-10-9-11-32(33)26-35(47)29-49)45-54(52)38-20-18-37(19-21-38)53-36-16-13-30(3)14-17-36/h9-22,25,27,35,45,49H,5-8,23-24,26,28-29H2,1-4H3/t35-,54?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.60E+4	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