Compile Data Set for Download or QSAR

Found 201 hits with Last Name = 'feese' and Initial = 'm'   

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
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328774 (2-(3-(3-cyclopentyl-5-(3-(2,3-dichlorophenyl)ureid...) Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)C1CCCC1 Show InChI InChI=1S/C23H23Cl2N5O2/c24-17-9-4-10-18(22(17)25)27-23(32)28-21-13-19(15-6-1-2-7-15)29-30(21)16-8-3-5-14(11-16)12-20(26)31/h3-5,8-11,13,15H,1-2,6-7,12H2,(H2,26,31)(H2,27,28,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328768 (1-(5-tert-Butyl-2-{4-[2-(1,1-dioxo-1lambda6-thiomo...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1ccc(CC(=O)N2CCS(=O)(=O)CC2)cc1 Show InChI InChI=1S/C26H29Cl2N5O4S/c1-26(2,3)21-16-22(30-25(35)29-20-6-4-5-19(27)24(20)28)33(31-21)18-9-7-17(8-10-18)15-23(34)32-11-13-38(36,37)14-12-32/h4-10,16H,11-15H2,1-3H3,(H2,29,30,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328755 (2-(3-(3-tert-butyl-5-(3-(2,3-dichlorophenyl)ureido...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1cccc(CC(N)=O)c1 Show InChI InChI=1S/C22H23Cl2N5O2/c1-22(2,3)17-12-19(27-21(31)26-16-9-5-8-15(23)20(16)24)29(28-17)14-7-4-6-13(10-14)11-18(25)30/h4-10,12H,11H2,1-3H3,(H2,25,30)(H2,26,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	MMDB Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328774 (2-(3-(3-cyclopentyl-5-(3-(2,3-dichlorophenyl)ureid...) Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)C1CCCC1 Show InChI InChI=1S/C23H23Cl2N5O2/c24-17-9-4-10-18(22(17)25)27-23(32)28-21-13-19(15-6-1-2-7-15)29-30(21)16-8-3-5-14(11-16)12-20(26)31/h3-5,8-11,13,15H,1-2,6-7,12H2,(H2,26,31)(H2,27,28,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50328755 (2-(3-(3-tert-butyl-5-(3-(2,3-dichlorophenyl)ureido...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1cccc(CC(N)=O)c1 Show InChI InChI=1S/C22H23Cl2N5O2/c1-22(2,3)17-12-19(27-21(31)26-16-9-5-8-15(23)20(16)24)29(28-17)14-7-4-6-13(10-14)11-18(25)30/h4-10,12H,11H2,1-3H3,(H2,25,30)(H2,26,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of CRAF				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328755 (2-(3-(3-tert-butyl-5-(3-(2,3-dichlorophenyl)ureido...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1cccc(CC(N)=O)c1 Show InChI InChI=1S/C22H23Cl2N5O2/c1-22(2,3)17-12-19(27-21(31)26-16-9-5-8-15(23)20(16)24)29(28-17)14-7-4-6-13(10-14)11-18(25)30/h4-10,12H,11H2,1-3H3,(H2,25,30)(H2,26,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	MMDB Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328773 (2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(thiophen...) Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccsc1 Show InChI InChI=1S/C22H17Cl2N5O2S/c23-16-5-2-6-17(21(16)24)26-22(31)27-20-11-18(14-7-8-32-12-14)28-29(20)15-4-1-3-13(9-15)10-19(25)30/h1-9,11-12H,10H2,(H2,25,30)(H2,26,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328769 (2-(3-(3-tert-butyl-5-(3-naphthalen-1-ylureido)-1H-...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1cccc(CC(N)=O)c1 Show InChI InChI=1S/C26H27N5O2/c1-26(2,3)22-16-24(31(30-22)19-11-6-8-17(14-19)15-23(27)32)29-25(33)28-21-13-7-10-18-9-4-5-12-20(18)21/h4-14,16H,15H2,1-3H3,(H2,27,32)(H2,28,29,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Homo sapiens (Human))	BDBM50328755 (2-(3-(3-tert-butyl-5-(3-(2,3-dichlorophenyl)ureido...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1cccc(CC(N)=O)c1 Show InChI InChI=1S/C22H23Cl2N5O2/c1-22(2,3)17-12-19(27-21(31)26-16-9-5-8-15(23)20(16)24)29(28-17)14-7-4-6-13(10-14)11-18(25)30/h4-10,12H,11H2,1-3H3,(H2,25,30)(H2,26,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of BRAF				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328769 (2-(3-(3-tert-butyl-5-(3-naphthalen-1-ylureido)-1H-...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1cccc(CC(N)=O)c1 Show InChI InChI=1S/C26H27N5O2/c1-26(2,3)22-16-24(31(30-22)19-11-6-8-17(14-19)15-23(27)32)29-25(33)28-21-13-7-10-18-9-4-5-12-20(18)21/h4-14,16H,15H2,1-3H3,(H2,27,32)(H2,28,29,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328771 (2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(2-fluoro...) Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccccc1F Show InChI InChI=1S/C24H18Cl2FN5O2/c25-17-8-4-10-19(23(17)26)29-24(34)30-22-13-20(16-7-1-2-9-18(16)27)31-32(22)15-6-3-5-14(11-15)12-21(28)33/h1-11,13H,12H2,(H2,28,33)(H2,29,30,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328766 (1-(3-tert-butyl-1-(4-(hydroxymethyl)phenyl)-1H-pyr...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1ccc(CO)cc1 Show InChI InChI=1S/C25H26N4O2/c1-25(2,3)22-15-23(29(28-22)19-13-11-17(16-30)12-14-19)27-24(31)26-21-10-6-8-18-7-4-5-9-20(18)21/h4-15,30H,16H2,1-3H3,(H2,26,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328773 (2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(thiophen...) Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccsc1 Show InChI InChI=1S/C22H17Cl2N5O2S/c23-16-5-2-6-17(21(16)24)26-22(31)27-20-11-18(14-7-8-32-12-14)28-29(20)15-4-1-3-13(9-15)10-19(25)30/h1-9,11-12H,10H2,(H2,25,30)(H2,26,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
DNA topoisomerase 1 (Homo sapiens (Human))	BDBM50073854 (2,10-dihydroxy-12-(3,4,5-trihydroxy-6-hydroxymethy...) Show SMILES OCC1OC(C(O)C(O)C1O)n1c2cc(O)ccc2c2c3C(=O)NC(=O)c3c3c4ccc(O)cc4[nH]c3c12 Show InChI InChI=1S/C26H21N3O9/c30-7-14-21(33)22(34)23(35)26(38-14)29-13-6-9(32)2-4-11(13)16-18-17(24(36)28-25(18)37)15-10-3-1-8(31)5-12(10)27-19(15)20(16)29/h1-6,14,21-23,26-27,30-35H,7H2,(H,28,36,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
deCODE BioStructures Curated by ChEMBL					Assay Description Inhibition of topoisomerase I-DNA complex in trapping assay				J Med Chem 48: 2336-45 (2005) Article DOI: 10.1021/jm049146p BindingDB Entry DOI: 10.7270/Q2CF9QVT
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328771 (2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(2-fluoro...) Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccccc1F Show InChI InChI=1S/C24H18Cl2FN5O2/c25-17-8-4-10-19(23(17)26)29-24(34)30-22-13-20(16-7-1-2-9-18(16)27)31-32(22)15-6-3-5-14(11-15)12-21(28)33/h1-11,13H,12H2,(H2,28,33)(H2,29,30,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328762 (1-(3-tert-butyl-1-(3-(2-morpholino-2-oxoethyl)phen...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1cccc(CC(=O)N2CCOCC2)c1 Show InChI InChI=1S/C30H33N5O3/c1-30(2,3)26-20-27(32-29(37)31-25-13-7-10-22-9-4-5-12-24(22)25)35(33-26)23-11-6-8-21(18-23)19-28(36)34-14-16-38-17-15-34/h4-13,18,20H,14-17,19H2,1-3H3,(H2,31,32,37)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328772 (2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(thiophen...) Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1cccs1 Show InChI InChI=1S/C22H17Cl2N5O2S/c23-15-6-2-7-16(21(15)24)26-22(31)27-20-12-17(18-8-3-9-32-18)28-29(20)14-5-1-4-13(10-14)11-19(25)30/h1-10,12H,11H2,(H2,25,30)(H2,26,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	MMDB Article PubMed	n/a	n/a	48	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328767 (3-(4-(3-tert-butyl-5-(3-naphthalen-1-ylureido)-1H-...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1ccc(CCC(O)=O)cc1 Show InChI InChI=1S/C27H28N4O3/c1-27(2,3)23-17-24(31(30-23)20-14-11-18(12-15-20)13-16-25(32)33)29-26(34)28-22-10-6-8-19-7-4-5-9-21(19)22/h4-12,14-15,17H,13,16H2,1-3H3,(H,32,33)(H2,28,29,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
DNA topoisomerase 1 (Homo sapiens (Human))	BDBM50008935 ((20S)-10-Dimethylaminomethyl-4-ethyl-4,9-dihydroxy...) Show SMILES CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccc(O)c(CN(C)C)c4cc3Cn1c2=O |r| Show InChI InChI=1S/C23H23N3O5/c1-4-23(30)16-8-18-20-12(9-26(18)21(28)15(16)11-31-22(23)29)7-13-14(10-25(2)3)19(27)6-5-17(13)24-20/h5-8,27,30H,4,9-11H2,1-3H3/t23-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
deCODE BioStructures Curated by ChEMBL					Assay Description Inhibition of topoisomerase I-DNA complex in trapping assay				J Med Chem 48: 2336-45 (2005) Article DOI: 10.1021/jm049146p BindingDB Entry DOI: 10.7270/Q2CF9QVT
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50327187 (1-{5-tert-Butyl-2-[3-(1,1,3-trioxo-1lambda*6*-[1,2...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccc(Cl)cc2)n(n1)-c1cccc(CN2C(O)=CNS2(=O)=O)c1 |c:30| Show InChI InChI=1S/C23H25ClN6O4S/c1-23(2,3)19-12-20(27-22(32)26-17-9-7-16(24)8-10-17)30(28-19)18-6-4-5-15(11-18)14-29-21(31)13-25-35(29,33)34/h4-13,25,31H,14H2,1-3H3,(H2,26,27,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328772 (2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-(thiophen...) Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1cccs1 Show InChI InChI=1S/C22H17Cl2N5O2S/c23-15-6-2-7-16(21(15)24)26-22(31)27-20-12-17(18-8-3-9-32-18)28-29(20)14-5-1-4-13(10-14)11-19(25)30/h1-10,12H,11H2,(H2,25,30)(H2,26,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	MMDB Article PubMed	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328763 (2-(3-(3-tert-butyl-5-(3-(4-chlorophenyl)ureido)-1H...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccc(Cl)cc2)n(n1)-c1cccc(CC(N)=O)c1 Show InChI InChI=1S/C22H24ClN5O2/c1-22(2,3)18-13-20(26-21(30)25-16-9-7-15(23)8-10-16)28(27-18)17-6-4-5-14(11-17)12-19(24)29/h4-11,13H,12H2,1-3H3,(H2,24,29)(H2,25,26,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328770 (2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-phenyl-1H...) Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccccc1 Show InChI InChI=1S/C24H19Cl2N5O2/c25-18-10-5-11-19(23(18)26)28-24(33)29-22-14-20(16-7-2-1-3-8-16)30-31(22)17-9-4-6-15(12-17)13-21(27)32/h1-12,14H,13H2,(H2,27,32)(H2,28,29,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to phosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Ephrin type-B receptor 2 (Homo sapiens (Human))	BDBM50328755 (2-(3-(3-tert-butyl-5-(3-(2,3-dichlorophenyl)ureido...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Cl)c2Cl)n(n1)-c1cccc(CC(N)=O)c1 Show InChI InChI=1S/C22H23Cl2N5O2/c1-22(2,3)17-12-19(27-21(31)26-16-9-5-8-15(23)20(16)24)29(28-17)14-7-4-6-13(10-14)11-18(25)30/h4-10,12H,11H2,1-3H3,(H2,25,30)(H2,26,27,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	82	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of EPHB2				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486321 (US10947210, Compound 26-7A) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCCOC3(CCCC3)C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H39FN2O9S/c1-34-30(36)28-25-19-24(21-5-6-21)26(20-27(25)44-29(28)22-7-9-23(33)10-8-22)35(45(2,39)40)13-14-41-15-16-42-17-18-43-32(31(37)38)11-3-4-12-32/h7-10,19-21H,3-6,11-18H2,1-2H3,(H,34,36)(H,37,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486329 (US10947210, Compound 28-8A) Show SMILES CNC(=O)c1c(oc2cc(N(CCCCCOCCCCC(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H37FN2O7S/c1-32-30(36)28-24-18-23(20-9-10-20)25(19-26(24)40-29(28)21-11-13-22(31)14-12-21)33(41(2,37)38)15-5-3-6-16-39-17-7-4-8-27(34)35/h11-14,18-20H,3-10,15-17H2,1-2H3,(H,32,36)(H,34,35)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486330 (US10947210, Compound 28-8B) Show SMILES CNC(=O)c1c(oc2cc(N(CCCCCOCCCC(C)C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C31H39FN2O7S/c1-20(31(36)37)8-7-17-40-16-6-4-5-15-34(42(3,38)39)26-19-27-25(18-24(26)21-9-10-21)28(30(35)33-2)29(41-27)22-11-13-23(32)14-12-22/h11-14,18-21H,4-10,15-17H2,1-3H3,(H,33,35)(H,36,37)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486076 (US10947210, Compound 06-7F) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCCOCc3cccc(c3)C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C34H37FN2O9S/c1-36-33(38)31-28-19-27(23-6-7-23)29(20-30(28)46-32(31)24-8-10-26(35)11-9-24)37(47(2,41)42)12-13-43-14-15-44-16-17-45-21-22-4-3-5-25(18-22)34(39)40/h3-5,8-11,18-20,23H,6-7,12-17,21H2,1-2H3,(H,36,38)(H,39,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486194 (US10947210, Compound 11-6A) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCCc3ccccc3C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H35FN2O8S/c1-35-32(37)30-27-19-26(22-7-8-22)28(20-29(27)44-31(30)23-9-11-24(34)12-10-23)36(45(2,40)41)14-16-43-18-17-42-15-13-21-5-3-4-6-25(21)33(38)39/h3-6,9-12,19-20,22H,7-8,13-18H2,1-2H3,(H,35,37)(H,38,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486200 (US10947210, Compound 11-6B) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCCc3cccc(c3)C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H35FN2O8S/c1-35-32(37)30-27-19-26(22-6-7-22)28(20-29(27)44-31(30)23-8-10-25(34)11-9-23)36(45(2,40)41)13-15-43-17-16-42-14-12-21-4-3-5-24(18-21)33(38)39/h3-5,8-11,18-20,22H,6-7,12-17H2,1-2H3,(H,35,37)(H,38,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486221 (US10947210, Compound 12-7A) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCCCc3ccccc3C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C34H37FN2O8S/c1-36-33(38)31-28-20-27(23-9-10-23)29(21-30(28)45-32(31)24-11-13-25(35)14-12-24)37(46(2,41)42)15-17-44-19-18-43-16-5-7-22-6-3-4-8-26(22)34(39)40/h3-4,6,8,11-14,20-21,23H,5,7,9-10,15-19H2,1-2H3,(H,36,38)(H,39,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486222 (US10947210, Compound 12-7B) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCCCc3cccc(c3)C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C34H37FN2O8S/c1-36-33(38)31-28-20-27(23-8-9-23)29(21-30(28)45-32(31)24-10-12-26(35)13-11-24)37(46(2,41)42)14-16-44-18-17-43-15-4-6-22-5-3-7-25(19-22)34(39)40/h3,5,7,10-13,19-21,23H,4,6,8-9,14-18H2,1-2H3,(H,36,38)(H,39,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486277 (US10947210, Compound 14-7A) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCCOc3ccccc3C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H35FN2O9S/c1-35-32(37)30-26-19-25(21-7-8-21)27(20-29(26)45-31(30)22-9-11-23(34)12-10-22)36(46(2,40)41)13-14-42-15-16-43-17-18-44-28-6-4-3-5-24(28)33(38)39/h3-6,9-12,19-21H,7-8,13-18H2,1-2H3,(H,35,37)(H,38,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486303 (US10947210, Compound 18-10B) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCc3ccc(cc3C)C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H35FN2O8S/c1-20-16-23(33(38)39)6-7-24(20)19-43-15-14-42-13-12-36(45(3,40)41)28-18-29-27(17-26(28)21-4-5-21)30(32(37)35-2)31(44-29)22-8-10-25(34)11-9-22/h6-11,16-18,21H,4-5,12-15,19H2,1-3H3,(H,35,37)(H,38,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486304 (US10947210, Compound 19-8A) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCc3ccnc(Cl)c3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H31ClFN3O6S/c1-33-30(36)28-24-16-23(20-3-4-20)25(17-26(24)41-29(28)21-5-7-22(32)8-6-21)35(42(2,37)38)11-12-39-13-14-40-18-19-9-10-34-27(31)15-19/h5-10,15-17,20H,3-4,11-14,18H2,1-2H3,(H,33,36)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486305 (US10947210, Compound 19-8B) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCc3ccc(Cl)nc3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H31ClFN3O6S/c1-33-30(36)28-24-15-23(20-4-5-20)25(16-26(24)41-29(28)21-6-8-22(32)9-7-21)35(42(2,37)38)11-12-39-13-14-40-18-19-3-10-27(31)34-17-19/h3,6-10,15-17,20H,4-5,11-14,18H2,1-2H3,(H,33,36)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486307 (US10947210, Compound 20-8) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCc3ccc(C(O)=O)c4ccccc34)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C36H35FN2O8S/c1-38-35(40)33-30-19-29(22-7-8-22)31(20-32(30)47-34(33)23-9-12-25(37)13-10-23)39(48(2,43)44)15-16-45-17-18-46-21-24-11-14-28(36(41)42)27-6-4-3-5-26(24)27/h3-6,9-14,19-20,22H,7-8,15-18,21H2,1-2H3,(H,38,40)(H,41,42)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486308 (US10947210, Compound 21-5) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCSC(C)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C26H29FN2O6S2/c1-16(30)36-13-12-34-11-10-29(37(3,32)33)22-15-23-21(14-20(22)17-4-5-17)24(26(31)28-2)25(35-23)18-6-8-19(27)9-7-18/h6-9,14-15,17H,4-5,10-13H2,1-3H3,(H,28,31)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328770 (2-(3-(5-(3-(2,3-dichlorophenyl)ureido)-3-phenyl-1H...) Show SMILES NC(=O)Cc1cccc(c1)-n1nc(cc1NC(=O)Nc1cccc(Cl)c1Cl)-c1ccccc1 Show InChI InChI=1S/C24H19Cl2N5O2/c25-18-10-5-11-19(23(18)26)28-24(33)29-22-14-20(16-7-2-1-3-8-16)30-31(22)17-9-4-6-15(12-17)13-21(27)32/h1-12,14H,13H2,(H2,27,32)(H2,28,29,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	119	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Binding affinity to unphosphorylated p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328756 (1-(3-tert-butyl-1-(3-((1-methyl-3,5-dioxo-1,2,4-tr...) Show SMILES Cn1[nH]c(=O)n(Cc2cccc(c2)-n2nc(cc2NC(=O)Nc2cccc3ccccc23)C(C)(C)C)c1=O Show InChI InChI=1S/C28H29N7O3/c1-28(2,3)23-16-24(30-25(36)29-22-14-8-11-19-10-5-6-13-21(19)22)35(31-23)20-12-7-9-18(15-20)17-34-26(37)32-33(4)27(34)38/h5-16H,17H2,1-4H3,(H,32,37)(H2,29,30,36)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	292	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
DNA topoisomerase 1 (Homo sapiens (Human))	BDBM50008923 ((S)-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-...) Show SMILES CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccccc4cc3Cn1c2=O |r| Show InChI InChI=1S/C20H16N2O4/c1-2-20(25)14-8-16-17-12(7-11-5-3-4-6-15(11)21-17)9-22(16)18(23)13(14)10-26-19(20)24/h3-8,25H,2,9-10H2,1H3/t20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
deCODE BioStructures Curated by ChEMBL					Assay Description Inhibition of topoisomerase I-DNA complex in trapping assay				J Med Chem 48: 2336-45 (2005) Article DOI: 10.1021/jm049146p BindingDB Entry DOI: 10.7270/Q2CF9QVT
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328757 (1-(3-tert-butyl-1-(3-((4,4-dimethyl-3,5-dioxopyraz...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(n1)-c1cccc(CN2NC(=O)C(C)(C)C2=O)c1 Show InChI InChI=1S/C30H32N6O3/c1-29(2,3)24-17-25(32-28(39)31-23-15-9-12-20-11-6-7-14-22(20)23)36(33-24)21-13-8-10-19(16-21)18-35-27(38)30(4,5)26(37)34-35/h6-17H,18H2,1-5H3,(H,34,37)(H2,31,32,39)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	384	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50328759 (1-(1-(3-(2-aminoethyl)phenyl)-3-tert-butyl-1H-pyra...) Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccc(Cl)cc2)n(n1)-c1cccc(CCN)c1 Show InChI InChI=1S/C22H26ClN5O/c1-22(2,3)19-14-20(26-21(29)25-17-9-7-16(23)8-10-17)28(27-19)18-6-4-5-15(13-18)11-12-24/h4-10,13-14H,11-12,24H2,1-3H3,(H2,25,26,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	508	n/a	n/a	n/a	n/a	n/a	n/a
Deciphera Pharmaceuticals LLC Curated by ChEMBL					Assay Description Inhibition of p38alpha by fluoroprobe binding assay				Bioorg Med Chem Lett 20: 5793-8 (2010) Article DOI: 10.1016/j.bmcl.2010.07.134 BindingDB Entry DOI: 10.7270/Q2XD11WK
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486333 (US10947210, Compound 29-9) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCc3ccc(C(=O)OC)c(N)c3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H36FN3O8S/c1-36-32(38)30-26-17-25(21-5-6-21)28(18-29(26)45-31(30)22-7-9-23(34)10-8-22)37(46(3,40)41)12-13-43-14-15-44-19-20-4-11-24(27(35)16-20)33(39)42-2/h4,7-11,16-18,21H,5-6,12-15,19,35H2,1-3H3,(H,36,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486334 (US10947210, Compound 29-10) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCc3ccc(C(O)=O)c(N)c3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H34FN3O8S/c1-35-31(37)29-25-16-24(20-4-5-20)27(17-28(25)44-30(29)21-6-8-22(33)9-7-21)36(45(2,40)41)11-12-42-13-14-43-18-19-3-10-23(32(38)39)26(34)15-19/h3,6-10,15-17,20H,4-5,11-14,18,34H2,1-2H3,(H,35,37)(H,38,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486332 (US10947210, Compound 29-8) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCc3ccc(C(O)=O)c(c3)[N+]([O-])=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H32FN3O10S/c1-34-31(37)29-25-16-24(20-4-5-20)26(17-28(25)46-30(29)21-6-8-22(33)9-7-21)35(47(2,42)43)11-12-44-13-14-45-18-19-3-10-23(32(38)39)27(15-19)36(40)41/h3,6-10,15-17,20H,4-5,11-14,18H2,1-2H3,(H,34,37)(H,38,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486331 (US10947210, Compound 29-7) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCc3ccc(C(=O)OC)c(c3)[N+]([O-])=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H34FN3O10S/c1-35-32(38)30-26-17-25(21-5-6-21)27(18-29(26)47-31(30)22-7-9-23(34)10-8-22)36(48(3,42)43)12-13-45-14-15-46-19-20-4-11-24(33(39)44-2)28(16-20)37(40)41/h4,7-11,16-18,21H,5-6,12-15,19H2,1-3H3,(H,35,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486327 (US10947210, Compound 27-9B) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCCCCOC(C)C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H37FN2O8S/c1-19(30(35)36)40-15-6-4-5-14-39-16-13-33(42(3,37)38)25-18-26-24(17-23(25)20-7-8-20)27(29(34)32-2)28(41-26)21-9-11-22(31)12-10-21/h9-12,17-20H,4-8,13-16H2,1-3H3,(H,32,34)(H,35,36)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486317 (US10947210, Compound 25-5) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCCOC(C(O)=O)c3ccccc3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C34H37FN2O9S/c1-36-33(38)30-27-20-26(22-8-9-22)28(21-29(27)46-31(30)24-10-12-25(35)13-11-24)37(47(2,41)42)14-15-43-16-17-44-18-19-45-32(34(39)40)23-6-4-3-5-7-23/h3-7,10-13,20-22,32H,8-9,14-19H2,1-2H3,(H,36,38)(H,39,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486322 (US10947210, Compound 26-7B) Show SMILES CNC(=O)c1c(oc2cc(N(CCOCCOCCOC(C)(C)C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H37FN2O9S/c1-30(2,29(35)36)41-16-15-40-14-13-39-12-11-33(43(4,37)38)24-18-25-23(17-22(24)19-5-6-19)26(28(34)32-3)27(42-25)20-7-9-21(31)10-8-20/h7-10,17-19H,5-6,11-16H2,1-4H3,(H,32,34)(H,35,36)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair

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