BDBM380768 (R)-6-(4-chlorophenyl)-5-(3,7-dimethyl-3H-[1,2,3]triazolo[4,5-b]pyridin-5-yl)-1-isopropyl-2-(2-methoxypyridin-3-yl)-5,6-dihydropyrrolo[3,4-d]imidazol-4(1H)-one::US9890166, Example 158

SMILES: COc1ncccc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(C)c2nnn(C)c2n1

InChI Key: InChIKey=VQVSQBFKHGXUFK-JOCHJYFZSA-N

Data: 4 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 4 hits for monomerid = 380768   

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
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM380768 ((R)-6-(4-chlorophenyl)-5-(3,7-dimethyl-3H-[1,2,3]t...) Show SMILES COc1ncccc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(C)c2nnn(C)c2n1 |r| Show InChI InChI=1S/C27H25ClN8O2/c1-14(2)35-23-21(31-24(35)18-7-6-12-29-26(18)38-5)27(37)36(22(23)16-8-10-17(28)11-9-16)19-13-15(3)20-25(30-19)34(4)33-32-20/h6-14,22H,1-5H3/t22-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<11	n/a	n/a	n/a	n/a	n/a	n/a
Amgen					Assay Description All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, plus 16 high- and...				Cancer Res 66: 8715-21 (2006) BindingDB Entry DOI: 10.7270/Q2TM7DFQ
					More data for this Ligand-Target Pair
CREB-binding protein (Homo sapiens (Human))	BDBM380768 ((R)-6-(4-chlorophenyl)-5-(3,7-dimethyl-3H-[1,2,3]t...) Show SMILES COc1ncccc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(C)c2nnn(C)c2n1 |r| Show InChI InChI=1S/C27H25ClN8O2/c1-14(2)35-23-21(31-24(35)18-7-6-12-29-26(18)38-5)27(37)36(22(23)16-8-10-17(28)11-9-16)19-13-15(3)20-25(30-19)34(4)33-32-20/h6-14,22H,1-5H3/t22-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>3.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Amgen					Assay Description In order to assess bromodomain selectivity, we set up a binding assay using the bromodomain encoded by the CREBBP gene. Compounds were tested in the ...				Cancer Res 66: 8715-21 (2006) BindingDB Entry DOI: 10.7270/Q2TM7DFQ
					More data for this Ligand-Target Pair
Bromodomain-containing protein 3 (Homo sapiens (Human))	BDBM380768 ((R)-6-(4-chlorophenyl)-5-(3,7-dimethyl-3H-[1,2,3]t...) Show SMILES COc1ncccc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(C)c2nnn(C)c2n1 |r| Show InChI InChI=1S/C27H25ClN8O2/c1-14(2)35-23-21(31-24(35)18-7-6-12-29-26(18)38-5)27(37)36(22(23)16-8-10-17(28)11-9-16)19-13-15(3)20-25(30-19)34(4)33-32-20/h6-14,22H,1-5H3/t22-/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<11	n/a	n/a	n/a	n/a	n/a	n/a
Amgen					Assay Description All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, plus 16 high- and...				Cancer Res 66: 8715-21 (2006) BindingDB Entry DOI: 10.7270/Q2TM7DFQ
					More data for this Ligand-Target Pair
Bromodomain-containing protein 2 (Homo sapiens (Human))	BDBM380768 ((R)-6-(4-chlorophenyl)-5-(3,7-dimethyl-3H-[1,2,3]t...) Show SMILES COc1ncccc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(C)c2nnn(C)c2n1 |r| Show InChI InChI=1S/C27H25ClN8O2/c1-14(2)35-23-21(31-24(35)18-7-6-12-29-26(18)38-5)27(37)36(22(23)16-8-10-17(28)11-9-16)19-13-15(3)20-25(30-19)34(4)33-32-20/h6-14,22H,1-5H3/t22-/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Amgen					Assay Description All assays were performed in 384 well microtiter plates. Each assay plate contained 8-point serial dilutions for 40 test compounds, plus 16 high- and...				Cancer Res 66: 8715-21 (2006) BindingDB Entry DOI: 10.7270/Q2TM7DFQ
					More data for this Ligand-Target Pair