Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Apoptosis regulator Bcl-2' and Ligand = 'BDBM177861'   

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))	BDBM177861 (US9120791, Example 83 | US9603854, 83) Show SMILES Cn1ccc2ccc(cc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCCc12)c1ccc(O)cc1 Show InChI InChI=1S/C46H46ClN5O4/c1-48-20-18-31-10-12-36(27-43(31)48)52(35-13-15-38(53)16-14-35)46(55)41-28-44(50-19-6-2-3-9-42(41)50)40-26-34(47)11-17-39(40)45(54)51-29-33-8-5-4-7-32(33)25-37(51)30-49-21-23-56-24-22-49/h4-5,7-8,10-18,20,26-28,37,53H,2-3,6,9,19,21-25,29-30H2,1H3/t37-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	18	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))	BDBM177861 (US9120791, Example 83 | US9603854, 83) Show SMILES Cn1ccc2ccc(cc12)N(C(=O)c1cc(-c2cc(Cl)ccc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCCc12)c1ccc(O)cc1 Show InChI InChI=1S/C46H46ClN5O4/c1-48-20-18-31-10-12-36(27-43(31)48)52(35-13-15-38(53)16-14-35)46(55)41-28-44(50-19-6-2-3-9-42(41)50)40-26-34(47)11-17-39(40)45(54)51-29-33-8-5-4-7-32(33)25-37(51)30-49-21-23-56-24-22-49/h4-5,7-8,10-18,20,26-28,37,53H,2-3,6,9,19,21-25,29-30H2,1H3/t37-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	18	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