Compile Data Set for Download or QSAR

Found 16 hits with Last Name = 'federov' and Initial = 'o'   

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))	BDBM50399443 (CHEMBL2179385) Show SMILES CN1Cc2cc(NS(=O)(=O)c3ccc(F)cc3Cl)ccc2NC1=O Show InChI InChI=1S/C15H13ClFN3O3S/c1-20-8-9-6-11(3-4-13(9)18-15(20)21)19-24(22,23)14-5-2-10(17)7-12(14)16/h2-7,19H,8H2,1H3,(H,18,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399434 (CHEMBL2179387) Show SMILES COc1ccccc1S(=O)(=O)Nc1ccc2NC(=O)N(C)Cc2c1 Show InChI InChI=1S/C16H17N3O4S/c1-19-10-11-9-12(7-8-13(11)17-16(19)20)18-24(21,22)15-6-4-3-5-14(15)23-2/h3-9,18H,10H2,1-2H3,(H,17,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399442 (CHEMBL2179386) Show SMILES CN1Cc2cc(NS(=O)(=O)c3ccccc3C)ccc2NC1=O Show InChI InChI=1S/C16H17N3O3S/c1-11-5-3-4-6-15(11)23(21,22)18-13-7-8-14-12(9-13)10-19(2)16(20)17-14/h3-9,18H,10H2,1-2H3,(H,17,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399441 (CHEMBL2179388) Show SMILES CN1Cc2cc(NS(=O)(=O)c3ccccc3F)ccc2NC1=O Show InChI InChI=1S/C15H14FN3O3S/c1-19-9-10-8-11(6-7-13(10)17-15(19)20)18-23(21,22)14-5-3-2-4-12(14)16/h2-8,18H,9H2,1H3,(H,17,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399440 (CHEMBL2179389) Show SMILES CN1Cc2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2NC1=O Show InChI InChI=1S/C16H17N3O3S/c1-11-3-6-14(7-4-11)23(21,22)18-13-5-8-15-12(9-13)10-19(2)16(20)17-15/h3-9,18H,10H2,1-2H3,(H,17,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399439 (CHEMBL2179390) Show SMILES CN1Cc2cc(NS(=O)(=O)c3ccccc3C(F)(F)F)ccc2NC1=O Show InChI InChI=1S/C16H14F3N3O3S/c1-22-9-10-8-11(6-7-13(10)20-15(22)23)21-26(24,25)14-5-3-2-4-12(14)16(17,18)19/h2-8,21H,9H2,1H3,(H,20,23)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399438 (CHEMBL2179391) Show SMILES COc1cccc(c1)S(=O)(=O)Nc1ccc2NC(=O)N(C)Cc2c1 Show InChI InChI=1S/C16H17N3O4S/c1-19-10-11-8-12(6-7-15(11)17-16(19)20)18-24(21,22)14-5-3-4-13(9-14)23-2/h3-9,18H,10H2,1-2H3,(H,17,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	730	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399436 (CHEMBL2179379) Show SMILES CN1Cc2cc(NS(=O)(=O)c3ccccc3)ccc2NC1=O Show InChI InChI=1S/C15H15N3O3S/c1-18-10-11-9-12(7-8-14(11)16-15(18)19)17-22(20,21)13-5-3-2-4-6-13/h2-9,17H,10H2,1H3,(H,16,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	880	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399437 (CHEMBL2179378) Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1ccc2NC(=O)N(C)Cc2c1 Show InChI InChI=1S/C16H17N3O4S/c1-19-10-11-9-12(3-8-15(11)17-16(19)20)18-24(21,22)14-6-4-13(23-2)5-7-14/h3-9,18H,10H2,1-2H3,(H,17,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	880	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399445 (CHEMBL2179383) Show SMILES CCNS(=O)(=O)c1ccc2NC(=O)N(C)Cc2c1 Show InChI InChI=1S/C11H15N3O3S/c1-3-12-18(16,17)9-4-5-10-8(6-9)7-14(2)11(15)13-10/h4-6,12H,3,7H2,1-2H3,(H,13,15)	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	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399435 (CHEMBL2179380) Show SMILES CN1Cc2cc(NS(=O)(=O)c3ccc(cc3)C#N)ccc2NC1=O Show InChI InChI=1S/C16H14N4O3S/c1-20-10-12-8-13(4-7-15(12)18-16(20)21)19-24(22,23)14-5-2-11(9-17)3-6-14/h2-8,19H,10H2,1H3,(H,18,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399444 (CHEMBL2179384) Show SMILES CN1Cc2cc(ccc2NC1=O)S(=O)(=O)Nc1ccccc1 Show InChI InChI=1S/C15H15N3O3S/c1-18-10-11-9-13(7-8-14(11)16-15(18)19)22(20,21)17-12-5-3-2-4-6-12/h2-9,17H,10H2,1H3,(H,16,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399446 (CHEMBL2179382) Show SMILES CN1Cc2cc(ccc2NC1=O)S(=O)(=O)N1CCCC1 Show InChI InChI=1S/C13H17N3O3S/c1-15-9-10-8-11(4-5-12(10)14-13(15)17)20(18,19)16-6-2-3-7-16/h4-5,8H,2-3,6-7,9H2,1H3,(H,14,17)	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	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399447 (CHEMBL2179381) Show SMILES CN1Cc2cc(Br)ccc2NC1=O Show InChI InChI=1S/C9H9BrN2O/c1-12-5-6-4-7(10)2-3-8(6)11-9(12)13/h2-4H,5H2,1H3,(H,11,13)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	2.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50399448 (CHEMBL1230189) Show SMILES CN1Cc2ccccc2NC1=O Show InChI InChI=1S/C9H10N2O/c1-11-6-7-4-2-3-5-8(7)10-9(11)12/h2-5H,6H2,1H3,(H,10,12)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	3.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of BRD4 isoform 1 by AlphaScreen assay				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair				3D Structure (crystal)
CREB-binding protein (Homo sapiens (Human))	BDBM50399434 (CHEMBL2179387) Show SMILES COc1ccccc1S(=O)(=O)Nc1ccc2NC(=O)N(C)Cc2c1 Show InChI InChI=1S/C16H17N3O4S/c1-19-10-11-9-12(7-8-13(11)17-16(19)20)18-24(21,22)15-6-4-3-5-14(15)23-2/h3-9,18H,10H2,1-2H3,(H,17,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	4.90E+4	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Binding affinity to CREBBP by SPR method				J Med Chem 55: 9831-7 (2012) Article DOI: 10.1021/jm3010515 BindingDB Entry DOI: 10.7270/Q20C4WXS
					More data for this Ligand-Target Pair