Compile Data Set for Download or QSAR

Found 120 hits with Last Name = 'wilson' and Initial = 'kp'   

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
Caspase-1 (Homo sapiens (Human))	BDBM50290014 ((S)-2-((S)-2-{(S)-2-[(S)-2-Acetylamino-3-(4-hydrox...) Show SMILES CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(O)=O Show InChI InChI=1S/C23H32N4O9/c1-11(2)19(22(34)24-12(3)20(32)26-17(23(35)36)10-18(30)31)27-21(33)16(25-13(4)28)9-14-5-7-15(29)8-6-14/h5-8,11-12,16-17,19,29H,9-10H2,1-4H3,(H,24,34)(H,25,28)(H,26,32)(H,27,33)(H,30,31)(H,35,36)/t12-,16-,17-,19-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50290012 ((S)-2-{(S)-2-[(S)-3-Methyl-2-(3-phenyl-propionylam...) Show SMILES CC(C)[C@H](NC(=O)CCc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(O)=O Show InChI InChI=1S/C21H29N3O7/c1-12(2)18(24-16(25)10-9-14-7-5-4-6-8-14)20(29)22-13(3)19(28)23-15(21(30)31)11-17(26)27/h4-8,12-13,15,18H,9-11H2,1-3H3,(H,22,29)(H,23,28)(H,24,25)(H,26,27)(H,30,31)/t13-,15-,18-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50290009 ((S)-3-(2-{3-[2-Acetylamino-2-(4-hydroxy-phenyl)-ac...) Show SMILES CC(=O)NC(C(=O)Nc1ccc(Cc2ccccc2)n(CC(=O)N[C@@H](CC(O)=O)C=O)c1=O)c1ccc(O)cc1 Show InChI InChI=1S/C28H28N4O8/c1-17(34)29-26(19-7-10-22(35)11-8-19)27(39)31-23-12-9-21(13-18-5-3-2-4-6-18)32(28(23)40)15-24(36)30-20(16-33)14-25(37)38/h2-12,16,20,26,35H,13-15H2,1H3,(H,29,34)(H,30,36)(H,31,39)(H,37,38)/t20-,26?/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50058529 ((S)-2-[(S)-2-((S)-2-Benzyloxycarbonylamino-3-methy...) Show SMILES CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(O)=O Show InChI InChI=1S/C20H27N3O8/c1-11(2)16(23-20(30)31-10-13-7-5-4-6-8-13)18(27)21-12(3)17(26)22-14(19(28)29)9-15(24)25/h4-8,11-12,14,16H,9-10H2,1-3H3,(H,21,27)(H,22,26)(H,23,30)(H,24,25)(H,28,29)/t12-,14-,16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article	55	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50099331 (4-(4-(4-fluorophenyl)-1-(piperidin-4-yl)-1H-imidaz...) Show SMILES Fc1ccc(cc1)-c1ncn(C2CCNCC2)c1-c1ccncc1 Show InChI InChI=1S/C19H19FN4/c20-16-3-1-14(2-4-16)18-19(15-5-9-21-10-6-15)24(13-23-18)17-7-11-22-12-8-17/h1-6,9-10,13,17,22H,7-8,11-12H2	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	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair				3D Structure (docked)
Caspase-1 (Homo sapiens (Human))	BDBM50290006 ((S)-3-{2-[6-Benzyl-2-oxo-3-(3-phenyl-propionylamin...) Show SMILES OC(=O)C[C@H](NC(=O)Cn1c(Cc2ccccc2)ccc(NC(=O)CCc2ccccc2)c1=O)C=O Show InChI InChI=1S/C27H27N3O6/c31-18-21(16-26(34)35)28-25(33)17-30-22(15-20-9-5-2-6-10-20)12-13-23(27(30)36)29-24(32)14-11-19-7-3-1-4-8-19/h1-10,12-13,18,21H,11,14-17H2,(H,28,33)(H,29,32)(H,34,35)/t21-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50290015 ((S)-4-Oxo-3-{(S)-2-[2-oxo-3-(3-phenyl-propionylami...) Show SMILES C[C@@H](C(=O)N[C@@H](CC(O)=O)C=O)n1cccc(NC(=O)CCc2ccccc2)c1=O Show InChI InChI=1S/C21H23N3O6/c1-14(20(29)22-16(13-25)12-19(27)28)24-11-5-8-17(21(24)30)23-18(26)10-9-15-6-3-2-4-7-15/h2-8,11,13-14,16H,9-10,12H2,1H3,(H,22,29)(H,23,26)(H,27,28)/t14-,16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 11 (Homo sapiens (Human))	BDBM15244 (5-(2,6-dichlorophenyl)-2-(2,4-difluorophenyl)sulfa...) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(F)c1 |(-1.69,6.87,;-1.69,5.33,;-.36,4.56,;-.36,3.02,;-1.69,2.25,;-1.69,.71,;-3.03,-.06,;-3.03,-1.6,;-4.36,-2.37,;-5.75,-1.54,;-7.08,-2.31,;-7.08,-3.85,;-5.75,-4.62,;-4.42,-3.85,;-5.75,-6.16,;-7.08,-6.93,;-8.42,-6.16,;-8.42,-4.62,;-9.75,-3.85,;-8.42,-1.54,;-9.75,-2.31,;-8.42,,;-7.08,.77,;-5.75,,;-4.36,.71,;-3.03,3.02,;-4.36,2.25,;-3.03,4.56,)| Show InChI InChI=1S/C19H9Cl2F2N3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	220	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38beta using KRELVEPLTPSGEAPNQALLR as substrate for 10 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50290011 ((S)-4-Oxo-3-{2-[2-oxo-6-phenyl-3-(3-phenyl-propion...) Show SMILES OC(=O)C[C@H](NC(=O)Cn1c(ccc(NC(=O)CCc2ccccc2)c1=O)-c1ccccc1)C=O Show InChI InChI=1S/C26H25N3O6/c30-17-20(15-25(33)34)27-24(32)16-29-22(19-9-5-2-6-10-19)13-12-21(26(29)35)28-23(31)14-11-18-7-3-1-4-8-18/h1-10,12-13,17,20H,11,14-16H2,(H,27,32)(H,28,31)(H,33,34)/t20-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50290005 ((S)-3-{2-[6-Benzyl-2-oxo-3-(3-phenyl-propionylamin...) Show SMILES CC(C(=O)N[C@@H](CC(O)=O)C=O)n1c(Cc2ccccc2)ccc(NC(=O)CCc2ccccc2)c1=O Show InChI InChI=1S/C28H29N3O6/c1-19(27(36)29-22(18-32)17-26(34)35)31-23(16-21-10-6-3-7-11-21)13-14-24(28(31)37)30-25(33)15-12-20-8-4-2-5-9-20/h2-11,13-14,18-19,22H,12,15-17H2,1H3,(H,29,36)(H,30,33)(H,34,35)/t19?,22-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	970	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50290007 ((S)-3-{2-[6-Butyl-2-oxo-3-(3-phenyl-propionylamino...) Show SMILES CCCCc1ccc(NC(=O)CCc2ccccc2)c(=O)n1CC(=O)N[C@@H](CC(O)=O)C=O Show InChI InChI=1S/C24H29N3O6/c1-2-3-9-19-11-12-20(26-21(29)13-10-17-7-5-4-6-8-17)24(33)27(19)15-22(30)25-18(16-28)14-23(31)32/h4-8,11-12,16,18H,2-3,9-10,13-15H2,1H3,(H,25,30)(H,26,29)(H,31,32)/t18-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50290013 ((S)-4-Oxo-3-{2-[2-oxo-6-phenethyl-3-(3-phenyl-prop...) Show SMILES OC(=O)C[C@H](NC(=O)Cn1c(CCc2ccccc2)ccc(NC(=O)CCc2ccccc2)c1=O)C=O Show InChI InChI=1S/C28H29N3O6/c32-19-22(17-27(35)36)29-26(34)18-31-23(13-11-20-7-3-1-4-8-20)14-15-24(28(31)37)30-25(33)16-12-21-9-5-2-6-10-21/h1-10,14-15,19,22H,11-13,16-18H2,(H,29,34)(H,30,33)(H,35,36)/t22-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50290016 ((S)-2-[2-((S)-2-Benzyloxycarbonylamino-3-methyl-bu...) Show SMILES CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(O)=O Show InChI InChI=1S/C19H25N3O8/c1-11(2)16(22-19(29)30-10-12-6-4-3-5-7-12)17(26)20-9-14(23)21-13(18(27)28)8-15(24)25/h3-7,11,13,16H,8-10H2,1-2H3,(H,20,26)(H,21,23)(H,22,29)(H,24,25)(H,27,28)/t13-,16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50290008 ((S)-3-{2-[6-Methyl-2-oxo-3-(3-phenyl-propionylamin...) Show SMILES Cc1ccc(NC(=O)CCc2ccccc2)c(=O)n1CC(=O)N[C@@H](CC(O)=O)C=O Show InChI InChI=1S/C21H23N3O6/c1-14-7-9-17(23-18(26)10-8-15-5-3-2-4-6-15)21(30)24(14)12-19(27)22-16(13-25)11-20(28)29/h2-7,9,13,16H,8,10-12H2,1H3,(H,22,27)(H,23,26)(H,28,29)/t16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Caspase-1 (Homo sapiens (Human))	BDBM50290010 ((S)-4-Oxo-3-{2-[2-oxo-3-(3-phenyl-propionylamino)-...) Show SMILES OC(=O)C[C@H](NC(=O)Cn1cccc(NC(=O)CCc2ccccc2)c1=O)C=O Show InChI InChI=1S/C20H21N3O6/c24-13-15(11-19(27)28)21-18(26)12-23-10-4-7-16(20(23)29)22-17(25)9-8-14-5-2-1-3-6-14/h1-7,10,13,15H,8-9,11-12H2,(H,21,26)(H,22,25)(H,27,28)/t15-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of IL-1 beta converting enzyme				Bioorg Med Chem Lett 7: 2181-2186 (1997) Article DOI: 10.1016/S0960-894X(97)00394-6 BindingDB Entry DOI: 10.7270/Q2VH5NT2
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM15244 (5-(2,6-dichlorophenyl)-2-(2,4-difluorophenyl)sulfa...) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(F)c1 |(-1.69,6.87,;-1.69,5.33,;-.36,4.56,;-.36,3.02,;-1.69,2.25,;-1.69,.71,;-3.03,-.06,;-3.03,-1.6,;-4.36,-2.37,;-5.75,-1.54,;-7.08,-2.31,;-7.08,-3.85,;-5.75,-4.62,;-4.42,-3.85,;-5.75,-6.16,;-7.08,-6.93,;-8.42,-6.16,;-8.42,-4.62,;-9.75,-3.85,;-8.42,-1.54,;-9.75,-2.31,;-8.42,,;-7.08,.77,;-5.75,,;-4.36,.71,;-3.03,3.02,;-4.36,2.25,;-3.03,4.56,)| Show InChI InChI=1S/C19H9Cl2F2N3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382379 (CHEMBL420134) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(Cl)c1 |(16.76,-12.29,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,;14.12,-7.65,;15.44,-9.96,)| Show InChI InChI=1S/C19H9Cl3FN3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(23)8-13(15)22/h1-9H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM15244 (5-(2,6-dichlorophenyl)-2-(2,4-difluorophenyl)sulfa...) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(F)c1 |(-1.69,6.87,;-1.69,5.33,;-.36,4.56,;-.36,3.02,;-1.69,2.25,;-1.69,.71,;-3.03,-.06,;-3.03,-1.6,;-4.36,-2.37,;-5.75,-1.54,;-7.08,-2.31,;-7.08,-3.85,;-5.75,-4.62,;-4.42,-3.85,;-5.75,-6.16,;-7.08,-6.93,;-8.42,-6.16,;-8.42,-4.62,;-9.75,-3.85,;-8.42,-1.54,;-9.75,-2.31,;-8.42,,;-7.08,.77,;-5.75,,;-4.36,.71,;-3.03,3.02,;-4.36,2.25,;-3.03,4.56,)| Show InChI InChI=1S/C19H9Cl2F2N3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM15244 (5-(2,6-dichlorophenyl)-2-(2,4-difluorophenyl)sulfa...) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(F)c1 |(-1.69,6.87,;-1.69,5.33,;-.36,4.56,;-.36,3.02,;-1.69,2.25,;-1.69,.71,;-3.03,-.06,;-3.03,-1.6,;-4.36,-2.37,;-5.75,-1.54,;-7.08,-2.31,;-7.08,-3.85,;-5.75,-4.62,;-4.42,-3.85,;-5.75,-6.16,;-7.08,-6.93,;-8.42,-6.16,;-8.42,-4.62,;-9.75,-3.85,;-8.42,-1.54,;-9.75,-2.31,;-8.42,,;-7.08,.77,;-5.75,,;-4.36,.71,;-3.03,3.02,;-4.36,2.25,;-3.03,4.56,)| Show InChI InChI=1S/C19H9Cl2F2N3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced TNFalpha production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382379 (CHEMBL420134) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(Cl)c1 |(16.76,-12.29,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,;14.12,-7.65,;15.44,-9.96,)| Show InChI InChI=1S/C19H9Cl3FN3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(23)8-13(15)22/h1-9H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382370 (CHEMBL326629) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)cc1 |(16.76,-12.29,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,;15.44,-9.96,)| Show InChI InChI=1S/C19H10Cl2FN3OS/c20-13-2-1-3-14(21)17(13)18-15-8-9-16(24-25(15)10-23-19(18)26)27-12-6-4-11(22)5-7-12/h1-10H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	99	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM13336 (4-[4-(4-fluorophenyl)-2-(4-methanesulfinylphenyl)-...) Show SMILES CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1 Show InChI InChI=1S/C21H16FN3OS/c1-27(26)18-8-4-16(5-9-18)21-24-19(14-2-6-17(22)7-3-14)20(25-21)15-10-12-23-13-11-15/h2-13H,1H3,(H,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382370 (CHEMBL326629) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)cc1 |(16.76,-12.29,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,;15.44,-9.96,)| Show InChI InChI=1S/C19H10Cl2FN3OS/c20-13-2-1-3-14(21)17(13)18-15-8-9-16(24-25(15)10-23-19(18)26)27-12-6-4-11(22)5-7-12/h1-10H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	123	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382375 (CHEMBL117211) Show SMILES Oc1ccccc1Sc1ccc2c(-c3c(Cl)cccc3Cl)c(=O)ncn2n1 |(14.12,-7.65,;14.12,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,)| Show InChI InChI=1S/C19H11Cl2N3O2S/c20-11-4-3-5-12(21)17(11)18-13-8-9-16(23-24(13)10-22-19(18)26)27-15-7-2-1-6-14(15)25/h1-10,25H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM15244 (5-(2,6-dichlorophenyl)-2-(2,4-difluorophenyl)sulfa...) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(F)c1 |(-1.69,6.87,;-1.69,5.33,;-.36,4.56,;-.36,3.02,;-1.69,2.25,;-1.69,.71,;-3.03,-.06,;-3.03,-1.6,;-4.36,-2.37,;-5.75,-1.54,;-7.08,-2.31,;-7.08,-3.85,;-5.75,-4.62,;-4.42,-3.85,;-5.75,-6.16,;-7.08,-6.93,;-8.42,-6.16,;-8.42,-4.62,;-9.75,-3.85,;-8.42,-1.54,;-9.75,-2.31,;-8.42,,;-7.08,.77,;-5.75,,;-4.36,.71,;-3.03,3.02,;-4.36,2.25,;-3.03,4.56,)| Show InChI InChI=1S/C19H9Cl2F2N3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human whole blood assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382380 (CHEMBL115491) Show SMILES Cc1cc(Cl)ccc1Sc1ccc2c(-c3c(Cl)cccc3Cl)c(=O)ncn2n1 |(14.12,-7.65,;14.12,-9.19,;15.44,-9.96,;15.44,-11.5,;16.76,-12.29,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.47,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,)| Show InChI InChI=1S/C20H12Cl3N3OS/c1-11-9-12(21)5-7-16(11)28-17-8-6-15-19(20(27)24-10-26(15)25-17)18-13(22)3-2-4-14(18)23/h2-10H,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced TNFalpha production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382378 (CHEMBL431865) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)cc1Cl |(16.76,-12.29,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,;15.44,-9.96,;16.78,-9.19,)| Show InChI InChI=1S/C19H9Cl3FN3OS/c20-11-2-1-3-12(21)17(11)18-15-6-7-16(25-26(15)9-24-19(18)27)28-10-4-5-14(23)13(22)8-10/h1-9H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	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
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382380 (CHEMBL115491) Show SMILES Cc1cc(Cl)ccc1Sc1ccc2c(-c3c(Cl)cccc3Cl)c(=O)ncn2n1 |(14.12,-7.65,;14.12,-9.19,;15.44,-9.96,;15.44,-11.5,;16.76,-12.29,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.47,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,)| Show InChI InChI=1S/C20H12Cl3N3OS/c1-11-9-12(21)5-7-16(11)28-17-8-6-15-19(20(27)24-10-26(15)25-17)18-13(22)3-2-4-14(18)23/h2-10H,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	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
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM15244 (5-(2,6-dichlorophenyl)-2-(2,4-difluorophenyl)sulfa...) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(F)c1 |(-1.69,6.87,;-1.69,5.33,;-.36,4.56,;-.36,3.02,;-1.69,2.25,;-1.69,.71,;-3.03,-.06,;-3.03,-1.6,;-4.36,-2.37,;-5.75,-1.54,;-7.08,-2.31,;-7.08,-3.85,;-5.75,-4.62,;-4.42,-3.85,;-5.75,-6.16,;-7.08,-6.93,;-8.42,-6.16,;-8.42,-4.62,;-9.75,-3.85,;-8.42,-1.54,;-9.75,-2.31,;-8.42,,;-7.08,.77,;-5.75,,;-4.36,.71,;-3.03,3.02,;-4.36,2.25,;-3.03,4.56,)| Show InChI InChI=1S/C19H9Cl2F2N3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human whole blood assessed as inhibition of LPS-induced TNFalpha production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair				3D Structure (crystal)
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382380 (CHEMBL115491) Show SMILES Cc1cc(Cl)ccc1Sc1ccc2c(-c3c(Cl)cccc3Cl)c(=O)ncn2n1 |(14.12,-7.65,;14.12,-9.19,;15.44,-9.96,;15.44,-11.5,;16.76,-12.29,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.47,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,)| Show InChI InChI=1S/C20H12Cl3N3OS/c1-11-9-12(21)5-7-16(11)28-17-8-6-15-19(20(27)24-10-26(15)25-17)18-13(22)3-2-4-14(18)23/h2-10H,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	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
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382357 (CHEMBL326089) Show SMILES Cc1ccccc1Sc1ccc2c(-c3c(Cl)cccc3Cl)c(=O)ncn2n1 |(14.12,-7.65,;14.12,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.47,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,)| Show InChI InChI=1S/C20H13Cl2N3OS/c1-12-5-2-3-8-16(12)27-17-10-9-15-19(20(26)23-11-25(15)24-17)18-13(21)6-4-7-14(18)22/h2-11H,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382373 (CHEMBL324089) Show SMILES Cc1cccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c1 |(16.78,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,)| Show InChI InChI=1S/C20H13Cl2N3OS/c1-12-4-2-5-13(10-12)27-17-9-8-16-19(20(26)23-11-25(16)24-17)18-14(21)6-3-7-15(18)22/h2-11H,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382358 (CHEMBL324091) Show SMILES Nc1cc(F)ccc1Sc1ccc2c(-c3c(Cl)cccc3Cl)c(=O)ncn2n1 |(15.3,-10.95,;15.3,-12.49,;16.63,-13.26,;16.63,-14.82,;17.95,-15.6,;15.28,-15.57,;13.96,-14.8,;13.97,-13.26,;12.64,-12.49,;11.3,-13.26,;11.29,-14.8,;9.96,-15.56,;8.64,-14.79,;7.29,-15.56,;7.29,-17.1,;8.64,-17.85,;9.96,-17.08,;8.64,-19.39,;7.29,-20.16,;5.95,-19.39,;5.95,-17.85,;4.63,-17.08,;5.98,-14.79,;4.65,-15.54,;5.98,-13.25,;7.29,-12.48,;8.64,-13.25,;9.98,-12.48,)| Show InChI InChI=1S/C19H11Cl2FN4OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H,23H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank 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
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382369 (CHEMBL113806) Show SMILES Clc1cccc(Cl)c1-c1c2ccc(Sc3ccccc3)nn2cnc1=O |(8.77,-13.77,;7.45,-14.54,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;6.11,-13.77,;6.11,-12.23,;7.45,-11.46,;8.77,-12.23,;10.11,-11.49,;10.12,-9.95,;11.45,-9.18,;12.78,-9.96,;14.12,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;8.79,-9.15,;7.45,-9.92,;6.11,-9.15,;4.79,-9.92,;4.79,-11.46,;3.46,-12.23,)| Show InChI InChI=1S/C19H11Cl2N3OS/c20-13-7-4-8-14(21)17(13)18-15-9-10-16(23-24(15)11-22-19(18)25)26-12-5-2-1-3-6-12/h1-11H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382381 (CHEMBL331361) Show SMILES Cc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(C)c1 |(16.76,-12.29,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.47,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,;14.12,-7.65,;15.44,-9.96,)| Show InChI InChI=1S/C21H15Cl2N3OS/c1-12-6-8-17(13(2)10-12)28-18-9-7-16-20(21(27)24-11-26(16)25-18)19-14(22)4-3-5-15(19)23/h3-11H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382379 (CHEMBL420134) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(Cl)c1 |(16.76,-12.29,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,;14.12,-7.65,;15.44,-9.96,)| Show InChI InChI=1S/C19H9Cl3FN3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(23)8-13(15)22/h1-9H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	275	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced TNFalpha production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382372 (CHEMBL114430) Show SMILES Clc1cccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c1 |(16.78,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,)| Show InChI InChI=1S/C19H10Cl3N3OS/c20-11-3-1-4-12(9-11)27-16-8-7-15-18(19(26)23-10-25(15)24-16)17-13(21)5-2-6-14(17)22/h1-10H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382373 (CHEMBL324089) Show SMILES Cc1cccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c1 |(16.78,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,)| Show InChI InChI=1S/C20H13Cl2N3OS/c1-12-4-2-5-13(10-12)27-17-9-8-16-19(20(26)23-11-25(16)24-17)18-14(21)6-3-7-15(18)22/h2-11H,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced TNFalpha production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382358 (CHEMBL324091) Show SMILES Nc1cc(F)ccc1Sc1ccc2c(-c3c(Cl)cccc3Cl)c(=O)ncn2n1 |(15.3,-10.95,;15.3,-12.49,;16.63,-13.26,;16.63,-14.82,;17.95,-15.6,;15.28,-15.57,;13.96,-14.8,;13.97,-13.26,;12.64,-12.49,;11.3,-13.26,;11.29,-14.8,;9.96,-15.56,;8.64,-14.79,;7.29,-15.56,;7.29,-17.1,;8.64,-17.85,;9.96,-17.08,;8.64,-19.39,;7.29,-20.16,;5.95,-19.39,;5.95,-17.85,;4.63,-17.08,;5.98,-14.79,;4.65,-15.54,;5.98,-13.25,;7.29,-12.48,;8.64,-13.25,;9.98,-12.48,)| Show InChI InChI=1S/C19H11Cl2FN4OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H,23H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382370 (CHEMBL326629) Show SMILES Fc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)cc1 |(16.76,-12.29,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,;15.44,-9.96,)| Show InChI InChI=1S/C19H10Cl2FN3OS/c20-13-2-1-3-14(21)17(13)18-15-8-9-16(24-25(15)10-23-19(18)26)27-12-6-4-11(22)5-7-12/h1-10H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	293	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced TNFalpha production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382381 (CHEMBL331361) Show SMILES Cc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c(C)c1 |(16.76,-12.29,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.47,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,;14.12,-7.65,;15.44,-9.96,)| Show InChI InChI=1S/C21H15Cl2N3OS/c1-12-6-8-17(13(2)10-12)28-18-9-7-16-20(21(27)24-11-26(16)25-18)19-14(22)4-3-5-15(19)23/h3-11H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced TNFalpha production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382357 (CHEMBL326089) Show SMILES Cc1ccccc1Sc1ccc2c(-c3c(Cl)cccc3Cl)c(=O)ncn2n1 |(14.12,-7.65,;14.12,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.47,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,)| Show InChI InChI=1S/C20H13Cl2N3OS/c1-12-5-2-3-8-16(12)27-17-10-9-15-19(20(26)23-11-25(15)24-17)18-13(21)6-4-7-14(18)22/h2-11H,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382372 (CHEMBL114430) Show SMILES Clc1cccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c1 |(16.78,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,)| Show InChI InChI=1S/C19H10Cl3N3OS/c20-11-3-1-4-12(9-11)27-16-8-7-15-18(19(26)23-10-25(15)24-16)17-13(21)5-2-6-14(17)22/h1-10H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382375 (CHEMBL117211) Show SMILES Oc1ccccc1Sc1ccc2c(-c3c(Cl)cccc3Cl)c(=O)ncn2n1 |(14.12,-7.65,;14.12,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;7.45,-14.54,;8.77,-13.77,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,)| Show InChI InChI=1S/C19H11Cl2N3O2S/c20-11-4-3-5-12(21)17(11)18-13-8-9-16(23-24(13)10-22-19(18)26)27-15-7-2-1-6-14(15)25/h1-10,25H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	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
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382356 (CHEMBL114121) Show SMILES Cc1ccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)cc1 |(16.76,-12.29,;15.44,-11.5,;15.44,-9.96,;14.12,-9.19,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.47,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;12.77,-11.5,;14.1,-12.27,)| Show InChI InChI=1S/C20H13Cl2N3OS/c1-12-5-7-13(8-6-12)27-17-10-9-16-19(20(26)23-11-25(16)24-17)18-14(21)3-2-4-15(18)22/h2-11H,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382369 (CHEMBL113806) Show SMILES Clc1cccc(Cl)c1-c1c2ccc(Sc3ccccc3)nn2cnc1=O |(8.77,-13.77,;7.45,-14.54,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;6.11,-13.77,;6.11,-12.23,;7.45,-11.46,;8.77,-12.23,;10.11,-11.49,;10.12,-9.95,;11.45,-9.18,;12.78,-9.96,;14.12,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;8.79,-9.15,;7.45,-9.92,;6.11,-9.15,;4.79,-9.92,;4.79,-11.46,;3.46,-12.23,)| Show InChI InChI=1S/C19H11Cl2N3OS/c20-13-7-4-8-14(21)17(13)18-15-9-10-16(23-24(15)11-22-19(18)25)26-12-5-2-1-3-6-12/h1-11H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 11 (Homo sapiens (Human))	BDBM13336 (4-[4-(4-fluorophenyl)-2-(4-methanesulfinylphenyl)-...) Show SMILES CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1 Show InChI InChI=1S/C21H16FN3OS/c1-27(26)18-8-4-16(5-9-18)21-24-19(14-2-6-17(22)7-3-14)20(25-21)15-10-12-23-13-11-15/h2-13H,1H3,(H,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38beta kinase				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382371 (CHEMBL114962) Show SMILES Fc1cccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c1 |(16.78,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,)| Show InChI InChI=1S/C19H10Cl2FN3OS/c20-13-5-2-6-14(21)17(13)18-15-7-8-16(24-25(15)10-23-19(18)26)27-12-4-1-3-11(22)9-12/h1-10H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced IL1beta production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382371 (CHEMBL114962) Show SMILES Fc1cccc(Sc2ccc3c(-c4c(Cl)cccc4Cl)c(=O)ncn3n2)c1 |(16.78,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;12.78,-9.96,;11.45,-9.18,;10.12,-9.95,;10.11,-11.49,;8.77,-12.23,;7.45,-11.46,;6.11,-12.23,;6.11,-13.77,;4.78,-14.54,;3.44,-13.77,;4.78,-16.08,;6.11,-16.85,;7.45,-16.08,;7.45,-14.54,;8.77,-13.77,;4.79,-11.46,;3.46,-12.23,;4.79,-9.92,;6.11,-9.15,;7.45,-9.92,;8.79,-9.15,;14.12,-9.19,)| Show InChI InChI=1S/C19H10Cl2FN3OS/c20-13-5-2-6-14(21)17(13)18-15-7-8-16(24-25(15)10-23-19(18)26)27-12-4-1-3-11(22)9-12/h1-10H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha kinase using KRELVEPLTPSGEAPNQALLR as substrate for 20 mins by lactate dehydrogenase-coupled spectrophotometric assay				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50382369 (CHEMBL113806) Show SMILES Clc1cccc(Cl)c1-c1c2ccc(Sc3ccccc3)nn2cnc1=O |(8.77,-13.77,;7.45,-14.54,;7.45,-16.08,;6.11,-16.85,;4.78,-16.08,;4.78,-14.54,;3.44,-13.77,;6.11,-13.77,;6.11,-12.23,;7.45,-11.46,;8.77,-12.23,;10.11,-11.49,;10.12,-9.95,;11.45,-9.18,;12.78,-9.96,;14.12,-9.19,;15.44,-9.96,;15.44,-11.5,;14.1,-12.27,;12.77,-11.5,;8.79,-9.15,;7.45,-9.92,;6.11,-9.15,;4.79,-9.92,;4.79,-11.46,;3.46,-12.23,)| Show InChI InChI=1S/C19H11Cl2N3OS/c20-13-7-4-8-14(21)17(13)18-15-9-10-16(23-24(15)11-22-19(18)25)26-12-5-2-1-3-6-12/h1-11H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of p38alpha in human PBMC assessed as inhibition of LPS-induced TNFalpha production after 16 to 18 hrs by ELISA				ACS Med Chem Lett 2: 758-763 (2011) Article DOI: 10.1021/ml2001455 BindingDB Entry DOI: 10.7270/Q26D5V19
					More data for this Ligand-Target Pair

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