Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Apoptosis regulator Bcl-2' and Ligand = 'BDBM177853'   

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))	BDBM177853 (US9120791, Example 74 | US9603854, 74) Show SMILES Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCNCc12)c1ccc(O)cc1 Show InChI InChI=1S/C45H44N6O6/c1-47-14-12-30-21-33(8-11-39(30)47)51(32-6-9-35(52)10-7-32)45(54)38-22-40(49-15-13-46-25-41(38)49)36-23-42-43(57-28-56-42)24-37(36)44(53)50-26-31-5-3-2-4-29(31)20-34(50)27-48-16-18-55-19-17-48/h2-12,14,21-24,34,46,52H,13,15-20,25-28H2,1H3/t34-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	24	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))	BDBM177853 (US9120791, Example 74 | US9603854, 74) Show SMILES Cn1ccc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCNCc12)c1ccc(O)cc1 Show InChI InChI=1S/C45H44N6O6/c1-47-14-12-30-21-33(8-11-39(30)47)51(32-6-9-35(52)10-7-32)45(54)38-22-40(49-15-13-46-25-41(38)49)36-23-42-43(57-28-56-42)24-37(36)44(53)50-26-31-5-3-2-4-29(31)20-34(50)27-48-16-18-55-19-17-48/h2-12,14,21-24,34,46,52H,13,15-20,25-28H2,1H3/t34-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	24	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