BDBM177831 US9120791, Example 50::US9120791, Example 94::US9603854, 94

SMILES: Cn1ncc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1

InChI Key: InChIKey=FZQUJWJPFIZNTR-UMSFTDKQSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 177831   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Apoptosis regulator Bcl-2 (Mus musculus (Mouse))	BDBM177831 (US9120791, Example 50 | US9120791, Example 94 | US...) Show SMILES Cn1ncc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1 Show InChI InChI=1S/C45H44N6O6/c1-47-39-14-11-33(21-31(39)25-46-47)51(32-9-12-35(52)13-10-32)45(54)38-22-41(49-15-5-4-8-40(38)49)36-23-42-43(57-28-56-42)24-37(36)44(53)50-26-30-7-3-2-6-29(30)20-34(50)27-48-16-18-55-19-17-48/h2-3,6-7,9-14,21-25,34,52H,4-5,8,15-20,26-28H2,1H3/t34-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	13	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
Apoptosis regulator Bcl-2 (Homo sapiens (Human))	BDBM177831 (US9120791, Example 50 | US9120791, Example 94 | US...) Show SMILES Cn1ncc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1 Show InChI InChI=1S/C45H44N6O6/c1-47-39-14-11-33(21-31(39)25-46-47)51(32-9-12-35(52)13-10-32)45(54)38-22-41(49-15-5-4-8-40(38)49)36-23-42-43(57-28-56-42)24-37(36)44(53)50-26-30-7-3-2-6-29(30)20-34(50)27-48-16-18-55-19-17-48/h2-3,6-7,9-14,21-25,34,52H,4-5,8,15-20,26-28H2,1H3/t34-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3	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))	BDBM177831 (US9120791, Example 50 | US9120791, Example 94 | US...) Show SMILES Cn1ncc2cc(ccc12)N(C(=O)c1cc(-c2cc3OCOc3cc2C(=O)N2Cc3ccccc3C[C@H]2CN2CCOCC2)n2CCCCc12)c1ccc(O)cc1 Show InChI InChI=1S/C45H44N6O6/c1-47-39-14-11-33(21-31(39)25-46-47)51(32-9-12-35(52)13-10-32)45(54)38-22-41(49-15-5-4-8-40(38)49)36-23-42-43(57-28-56-42)24-37(36)44(53)50-26-30-7-3-2-6-29(30)20-34(50)27-48-16-18-55-19-17-48/h2-3,6-7,9-14,21-25,34,52H,4-5,8,15-20,26-28H2,1H3/t34-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3	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