Compile Data Set for Download or QSAR

Found 23 hits Enz. Inhib. hit(s) with all data for assayid = 2 entry = 50042874   

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
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432472 (CHEMBL2349340) Show SMILES Cc1[nH]nc2[C@H](CC(=O)OC(C)(C)C)N=C(c3c(C)c(C)sc3-c12)c1ccc(Cl)cc1 |r,c:14| Show InChI InChI=1S/C24H26ClN3O2S/c1-12-14(3)31-23-19(12)21(15-7-9-16(25)10-8-15)26-17(11-18(29)30-24(4,5)6)22-20(23)13(2)27-28-22/h7-10,17H,11H2,1-6H3,(H,27,28)/t17-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432476 (CHEMBL2349361) Show SMILES O=C(Nc1cc(NS(=O)(=O)c2cccs2)cc(c1)-c1csc(=O)[nH]1)c1cccs1 Show InChI InChI=1S/C18H13N3O4S4/c22-17(15-3-1-5-26-15)19-12-7-11(14-10-28-18(23)20-14)8-13(9-12)21-29(24,25)16-4-2-6-27-16/h1-10,21H,(H,19,22)(H,20,23)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432474 (CHEMBL2349363) Show SMILES O=C(CCc1ccccc1)Nc1cc(NS(=O)(=O)c2cccs2)cc(c1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C22H19N3O4S3/c26-20(9-8-15-5-2-1-3-6-15)23-17-11-16(19-14-31-22(27)24-19)12-18(13-17)25-32(28,29)21-7-4-10-30-21/h1-7,10-14,25H,8-9H2,(H,23,26)(H,24,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	570	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432473 (CHEMBL2349462) Show SMILES CCCC(=O)Nc1cc(NS(=O)(=O)c2cccs2)cc(c1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C17H17N3O4S3/c1-2-4-15(21)18-12-7-11(14-10-26-17(22)19-14)8-13(9-12)20-27(23,24)16-5-3-6-25-16/h3,5-10,20H,2,4H2,1H3,(H,18,21)(H,19,22)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	790	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50353589 (CHEMBL1828979) Show SMILES Cc1noc(C)c1-c1ccccc1 Show InChI InChI=1S/C11H11NO/c1-8-11(9(2)13-12-8)10-6-4-3-5-7-10/h3-7H,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432475 (CHEMBL2349362) Show SMILES O=C(CCC1CCCCC1)Nc1cc(NS(=O)(=O)c2cccs2)cc(c1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C22H25N3O4S3/c26-20(9-8-15-5-2-1-3-6-15)23-17-11-16(19-14-31-22(27)24-19)12-18(13-17)25-32(28,29)21-7-4-10-30-21/h4,7,10-15,25H,1-3,5-6,8-9H2,(H,23,26)(H,24,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432478 (CHEMBL2349358) Show SMILES CCCC(=O)Nc1cc(ccc1NS(=O)(=O)c1cccs1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C17H17N3O4S3/c1-2-4-15(21)18-13-9-11(14-10-26-17(22)19-14)6-7-12(13)20-27(23,24)16-5-3-8-25-16/h3,5-10,20H,2,4H2,1H3,(H,18,21)(H,19,22)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432477 (CHEMBL2349359) Show SMILES O=C(Nc1cc(ccc1NS(=O)(=O)c1cccs1)-c1csc(=O)[nH]1)C1CCCC1 Show InChI InChI=1S/C19H19N3O4S3/c23-18(12-4-1-2-5-12)20-15-10-13(16-11-28-19(24)21-16)7-8-14(15)22-29(25,26)17-6-3-9-27-17/h3,6-12,22H,1-2,4-5H2,(H,20,23)(H,21,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432479 (CHEMBL2349357) Show SMILES O=C(CCc1ccccc1)Nc1cc(ccc1NS(=O)(=O)c1cccs1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C22H19N3O4S3/c26-20(11-8-15-5-2-1-3-6-15)23-18-13-16(19-14-31-22(27)24-19)9-10-17(18)25-32(28,29)21-7-4-12-30-21/h1-7,9-10,12-14,25H,8,11H2,(H,23,26)(H,24,27)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432481 (CHEMBL2349355) Show SMILES Nc1cc(NS(=O)(=O)c2cccs2)cc(c1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C13H11N3O3S3/c14-9-4-8(11-7-21-13(17)15-11)5-10(6-9)16-22(18,19)12-2-1-3-20-12/h1-7,16H,14H2,(H,15,17)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432482 (CHEMBL2349354) Show SMILES Oc1cc(ccc1NS(=O)(=O)c1cccs1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C13H10N2O4S3/c16-11-6-8(10-7-21-13(17)14-10)3-4-9(11)15-22(18,19)12-2-1-5-20-12/h1-7,15-16H,(H,14,17)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432480 (CHEMBL2349356) Show SMILES O=C(Cc1ccccc1)Nc1cc(ccc1NS(=O)(=O)c1cccs1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C21H17N3O4S3/c25-19(11-14-5-2-1-3-6-14)22-17-12-15(18-13-30-21(26)23-18)8-9-16(17)24-31(27,28)20-7-4-10-29-20/h1-10,12-13,24H,11H2,(H,22,25)(H,23,26)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432485 (CHEMBL2349350) Show SMILES Fc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C15H11FN2O3S2/c16-11-4-6-13(7-5-11)23(20,21)18-12-3-1-2-10(8-12)14-9-22-15(19)17-14/h1-9,18H,(H,17,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432487 (CHEMBL2349347) Show SMILES O=c1[nH]c(cs1)-c1cccc(NS(=O)(=O)Cc2ccccc2)c1 Show InChI InChI=1S/C16H14N2O3S2/c19-16-17-15(10-22-16)13-7-4-8-14(9-13)18-23(20,21)11-12-5-2-1-3-6-12/h1-10,18H,11H2,(H,17,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432486 (CHEMBL2349349) Show SMILES O=c1[nH]c(cs1)-c1cccc(NS(=O)(=O)c2cccs2)c1 Show InChI InChI=1S/C13H10N2O3S3/c16-13-14-11(8-20-13)9-3-1-4-10(7-9)15-21(17,18)12-5-2-6-19-12/h1-8,15H,(H,14,16)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432488 (CHEMBL2349346) Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C16H14N2O4S2/c1-22-13-5-7-14(8-6-13)24(20,21)18-12-4-2-3-11(9-12)15-10-23-16(19)17-15/h2-10,18H,1H3,(H,17,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432484 (CHEMBL2349351) Show SMILES O=c1[nH]c(cs1)-c1cccc(NS(=O)(=O)c2cccnc2)c1 Show InChI InChI=1S/C14H11N3O3S2/c18-14-16-13(9-21-14)10-3-1-4-11(7-10)17-22(19,20)12-5-2-6-15-8-12/h1-9,17H,(H,16,18)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432483 (CHEMBL2346691) Show SMILES O=c1[nH]c(cs1)-c1cccc(NCCc2ccccc2)c1 Show InChI InChI=1S/C17H16N2OS/c20-17-19-16(12-21-17)14-7-4-8-15(11-14)18-10-9-13-5-2-1-3-6-13/h1-8,11-12,18H,9-10H2,(H,19,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.28E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432490 (CHEMBL2349344) Show SMILES Nc1ccc(cc1O)-c1csc(=O)[nH]1 Show InChI InChI=1S/C9H8N2O2S/c10-6-2-1-5(3-8(6)12)7-4-14-9(13)11-7/h1-4,12H,10H2,(H,11,13)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432493 (CHEMBL2349341) Show SMILES Clc1cccc(c1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C9H6ClNOS/c10-7-3-1-2-6(4-7)8-5-13-9(12)11-8/h1-5H,(H,11,12)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432492 (CHEMBL2349342) Show SMILES Nc1cccc(c1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C9H8N2OS/c10-7-3-1-2-6(4-7)8-5-13-9(12)11-8/h1-5H,10H2,(H,11,12)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432489 (CHEMBL2349345) Show SMILES Nc1cc(N)cc(c1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C9H9N3OS/c10-6-1-5(2-7(11)3-6)8-4-14-9(13)12-8/h1-4H,10-11H2,(H,12,13)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.07E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50432491 (CHEMBL2349343) Show SMILES Nc1ccc(cc1)-c1csc(=O)[nH]1 Show InChI InChI=1S/C9H8N2OS/c10-7-3-1-6(2-4-7)8-5-13-9(12)11-8/h1-5H,10H2,(H,11,12)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Displacement of FITC-labeled (+)-JQ1 from bromodomain BRD4(1) (unknown origin) expressed in Escherichia coli BL21(DE3) after 4 hrs by fluorescence an...				J Med Chem 56: 3833-51 (2013) Article DOI: 10.1021/jm301793a BindingDB Entry DOI: 10.7270/Q2P55PVX
					More data for this Ligand-Target Pair