Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Apoptosis regulator Bcl-2' and Ligand = 'BDBM177879'   

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))	BDBM177879 (US9120791, Example 107 | US9603854, 107) Show SMILES CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3ccc4n(C)ccc4c3)c3CCCCn23)CC1=O Show InChI InChI=1S/C46H45ClN6O4/c1-48-20-18-31-24-35(13-17-41(31)48)53(34-11-14-37(54)15-12-34)46(57)40-26-43(51-19-6-5-9-42(40)51)39-25-33(47)10-16-38(39)45(56)52-27-32-8-4-3-7-30(32)23-36(52)28-50-22-21-49(2)44(55)29-50/h3-4,7-8,10-18,20,24-26,36,54H,5-6,9,19,21-23,27-29H2,1-2H3/t36-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD US Patent					Assay Description The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, at a final concentration of 2.50×10−8 M, is...				US Patent US9603854 (2017) BindingDB Entry DOI: 10.7270/Q2GX4DMT
					More data for this Ligand-Target Pair
Apoptosis regulator Bcl-2 (Mus musculus (Mouse))	BDBM177879 (US9120791, Example 107 | US9603854, 107) Show SMILES CN1CCN(C[C@@H]2Cc3ccccc3CN2C(=O)c2ccc(Cl)cc2-c2cc(C(=O)N(c3ccc(O)cc3)c3ccc4n(C)ccc4c3)c3CCCCn23)CC1=O Show InChI InChI=1S/C46H45ClN6O4/c1-48-20-18-31-24-35(13-17-41(31)48)53(34-11-14-37(54)15-12-34)46(57)40-26-43(51-19-6-5-9-42(40)51)39-25-33(47)10-16-38(39)45(56)52-27-32-8-4-3-7-30(32)23-36(52)28-50-22-21-49(2)44(55)29-50/h3-4,7-8,10-18,20,24-26,36,54H,5-6,9,19,21-23,27-29H2,1-2H3/t36-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	7	n/a	n/a	n/a	n/a	7.4	n/a
LES LABORATOIRES SERVIER; VERNALIS (R&D) LTD US Patent					Assay Description The fluorescence polarisation tests were carried out on microplates (384 wells). The Bcl-2 protein, at a final concentration of 2.50×10−8 M, is...				US Patent US9120791 (2015) BindingDB Entry DOI: 10.7270/Q21N7ZWC
					More data for this Ligand-Target Pair