Found 36 hits of Enzyme Inhibition Constant Data 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)) | BDBM50156835
(CHEMBL374762 | N-{4-[5-(4-fluorophenyl)-2-(4-methy...)Show SMILES COCCn1c(SCc2ccc(cc2)S(C)=O)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C27H27FN4O3S2/c1-18(33)30-24-16-21(12-13-29-24)26-25(20-6-8-22(28)9-7-20)31-27(32(26)14-15-35-2)36-17-19-4-10-23(11-5-19)37(3)34/h4-13,16H,14-15,17H2,1-3H3,(H,29,30,33) | 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 | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156842
(CHEMBL222920 | N-{4-[5-(4-fluorophenyl)-3-(3-metho...)Show SMILES COCCCn1c(SC)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C21H23FN4O2S/c1-14(27)24-18-13-16(9-10-23-18)20-19(15-5-7-17(22)8-6-15)25-21(29-3)26(20)11-4-12-28-2/h5-10,13H,4,11-12H2,1-3H3,(H,23,24,27) | 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 | 205 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156820
(CHEMBL426183 | N-{4-[5-(4-fluorophenyl)-3-(2-metho...)Show SMILES COCCn1c(SC)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C20H21FN4O2S/c1-13(26)23-17-12-15(8-9-22-17)19-18(14-4-6-16(21)7-5-14)24-20(28-3)25(19)10-11-27-2/h4-9,12H,10-11H2,1-3H3,(H,22,23,26) | 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 | 218 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156821
(CHEMBL373807 | N-{4-[5-(4-fluorophenyl)-3-(2-hydro...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CCO)-c1ccc(F)cc1 Show InChI InChI=1S/C19H19FN4O2S/c1-12(26)22-16-11-14(7-8-21-16)18-17(13-3-5-15(20)6-4-13)23-19(27-2)24(18)9-10-25/h3-8,11,25H,9-10H2,1-2H3,(H,21,22,26) | 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 | 398 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156839
(CHEMBL376608 | N-{4-[5-(4-fluorophenyl)-2-methylsu...)Show SMILES CSCCn1c(SC)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C20H21FN4OS2/c1-13(26)23-17-12-15(8-9-22-17)19-18(14-4-6-16(21)7-5-14)24-20(28-3)25(19)10-11-27-2/h4-9,12H,10-11H2,1-3H3,(H,22,23,26) | 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 | 431 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156826
(CHEMBL221985 | N-{4-[5-(4-fluorophenyl)-3-(2-metho...)Show SMILES COCCn1c(SCCC(=O)N2CCOCC2)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C26H30FN5O4S/c1-18(33)29-22-17-20(7-9-28-22)25-24(19-3-5-21(27)6-4-19)30-26(32(25)12-13-35-2)37-16-8-23(34)31-10-14-36-15-11-31/h3-7,9,17H,8,10-16H2,1-2H3,(H,28,29,33) | 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 | 460 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
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 | 462 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156819
(CHEMBL221508 | N-{4-[5-(4-fluorophenyl)-2-methylsu...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CCOCC#C)-c1ccc(F)cc1 Show InChI InChI=1S/C22H21FN4O2S/c1-4-12-29-13-11-27-21(17-9-10-24-19(14-17)25-15(2)28)20(26-22(27)30-3)16-5-7-18(23)8-6-16/h1,5-10,14H,11-13H2,2-3H3,(H,24,25,28) | 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 | 666 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156828
(CHEMBL374531 | N-{4-[5-(4-fluorophenyl)-3-(3-hydro...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CCCO)-c1ccc(F)cc1 Show InChI InChI=1S/C20H21FN4O2S/c1-13(27)23-17-12-15(8-9-22-17)19-18(14-4-6-16(21)7-5-14)24-20(28-2)25(19)10-3-11-26/h4-9,12,26H,3,10-11H2,1-2H3,(H,22,23,27) | 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 | 813 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156815
(CHEMBL222339 | N-{4-[5-(4-fluorophenyl)-2-(4-methy...)Show SMILES COCCCn1c(SCc2ccc(cc2)S(C)=O)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C28H29FN4O3S2/c1-19(34)31-25-17-22(13-14-30-25)27-26(21-7-9-23(29)10-8-21)32-28(33(27)15-4-16-36-2)37-18-20-5-11-24(12-6-20)38(3)35/h5-14,17H,4,15-16,18H2,1-3H3,(H,30,31,34) | 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 | 1.31E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156817
(CHEMBL221568 | N-{4-[5-(4-fluorophenyl)-2-methylsu...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CCN1CCCCC1)-c1ccc(F)cc1 Show InChI InChI=1S/C24H28FN5OS/c1-17(31)27-21-16-19(10-11-26-21)23-22(18-6-8-20(25)9-7-18)28-24(32-2)30(23)15-14-29-12-4-3-5-13-29/h6-11,16H,3-5,12-15H2,1-2H3,(H,26,27,31) | 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 | 1.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156816
(CHEMBL223645 | N-{4-[3-(2-allyloxyethyl)-5-(4-fluo...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CCOCC=C)-c1ccc(F)cc1 Show InChI InChI=1S/C22H23FN4O2S/c1-4-12-29-13-11-27-21(17-9-10-24-19(14-17)25-15(2)28)20(26-22(27)30-3)16-5-7-18(23)8-6-16/h4-10,14H,1,11-13H2,2-3H3,(H,24,25,28) | 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 | 1.85E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156837
(CHEMBL389266 | N-{4-[5-(4-fluorophenyl)-3-(2-hydro...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCCCC(=O)N2CCOCC2)n1CCO)-c1ccc(F)cc1 Show InChI InChI=1S/C26H30FN5O4S/c1-18(34)29-22-17-20(8-9-28-22)25-24(19-4-6-21(27)7-5-19)30-26(32(25)10-13-33)37-16-2-3-23(35)31-11-14-36-15-12-31/h4-9,17,33H,2-3,10-16H2,1H3,(H,28,29,34) | 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 | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156827
(CHEMBL387551 | N-{4-[5-(4-fluorophenyl)-3-(2-morph...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CCN1CCOCC1)-c1ccc(F)cc1 Show InChI InChI=1S/C23H26FN5O2S/c1-16(30)26-20-15-18(7-8-25-20)22-21(17-3-5-19(24)6-4-17)27-23(32-2)29(22)10-9-28-11-13-31-14-12-28/h3-8,15H,9-14H2,1-2H3,(H,25,26,30) | 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 | 2.03E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156831
(CHEMBL373913 | N-{4-[5-(4-fluorophenyl)-3-(2-hydro...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCc2ccc(cc2)S(C)=O)n1CCO)-c1ccc(F)cc1 Show InChI InChI=1S/C26H25FN4O3S2/c1-17(33)29-23-15-20(11-12-28-23)25-24(19-5-7-21(27)8-6-19)30-26(31(25)13-14-32)35-16-18-3-9-22(10-4-18)36(2)34/h3-12,15,32H,13-14,16H2,1-2H3,(H,28,29,33) | 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 | 2.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156847
(CHEMBL222051 | N-{4-[5-(4-fluorophenyl)-2-(4-methy...)Show SMILES CSCCn1c(SCc2ccc(cc2)S(C)=O)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C27H27FN4O2S3/c1-18(33)30-24-16-21(12-13-29-24)26-25(20-6-8-22(28)9-7-20)31-27(32(26)14-15-35-2)36-17-19-4-10-23(11-5-19)37(3)34/h4-13,16H,14-15,17H2,1-3H3,(H,29,30,33) | 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 | 2.38E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156825
(CHEMBL373808 | N-{4-[3-(2-dimethylaminoethyl)-5-(4...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CCN(C)C)-c1ccc(F)cc1 Show InChI InChI=1S/C21H24FN5OS/c1-14(28)24-18-13-16(9-10-23-18)20-19(15-5-7-17(22)8-6-15)25-21(29-4)27(20)12-11-26(2)3/h5-10,13H,11-12H2,1-4H3,(H,23,24,28) | 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 | 2.41E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156836
(CHEMBL225548 | N-{4-[5-(4-fluorophenyl)-3-(2-hydro...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCCC(=O)N2CCOCC2)n1CCO)-c1ccc(F)cc1 Show InChI InChI=1S/C25H28FN5O4S/c1-17(33)28-21-16-19(6-8-27-21)24-23(18-2-4-20(26)5-3-18)29-25(31(24)9-12-32)36-15-7-22(34)30-10-13-35-14-11-30/h2-6,8,16,32H,7,9-15H2,1H3,(H,27,28,33) | 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 | 2.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156834
(CHEMBL225458 | N-{4-[3-(2,2-dimethyl[1,3]dioxolan-...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CC1COC(C)(C)O1)-c1ccc(F)cc1 Show InChI InChI=1S/C23H25FN4O3S/c1-14(29)26-19-11-16(9-10-25-19)21-20(15-5-7-17(24)8-6-15)27-22(32-4)28(21)12-18-13-30-23(2,3)31-18/h5-11,18H,12-13H2,1-4H3,(H,25,26,29) | 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 | 3.73E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156832
(CHEMBL374756 | N-{4-[3-(2,2-dimethoxyethyl)-5-(4-f...)Show SMILES COC(Cn1c(SC)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1)OC Show InChI InChI=1S/C21H23FN4O3S/c1-13(27)24-17-11-15(9-10-23-17)20-19(14-5-7-16(22)8-6-14)25-21(30-4)26(20)12-18(28-2)29-3/h5-11,18H,12H2,1-4H3,(H,23,24,27) | 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 | 4.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156845
(CHEMBL225231 | N-{4-[5-(4-fluorophenyl)-2-(4-methy...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCc2ccc(cc2)S(C)=O)n1CCN1CCCCC1)-c1ccc(F)cc1 Show InChI InChI=1S/C31H34FN5O2S2/c1-22(38)34-28-20-25(14-15-33-28)30-29(24-8-10-26(32)11-9-24)35-31(37(30)19-18-36-16-4-3-5-17-36)40-21-23-6-12-27(13-7-23)41(2)39/h6-15,20H,3-5,16-19,21H2,1-2H3,(H,33,34,38) | 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 | 4.44E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156844
(CHEMBL225101 | N-{4-[5-(4-fluorophenyl)-2-(4-methy...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCc2ccc(cc2)S(C)=O)n1CCOCC#C)-c1ccc(F)cc1 Show InChI InChI=1S/C29H27FN4O3S2/c1-4-16-37-17-15-34-28(23-13-14-31-26(18-23)32-20(2)35)27(22-7-9-24(30)10-8-22)33-29(34)38-19-21-5-11-25(12-6-21)39(3)36/h1,5-14,18H,15-17,19H2,2-3H3,(H,31,32,35) | 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 | 4.97E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156841
(CHEMBL387154 | N-{4-[5-(4-fluorophenyl)-2-(4-methy...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCc2ccc(cc2)S(C)=O)n1C)-c1ccc(F)cc1 Show InChI InChI=1S/C25H23FN4O2S2/c1-16(31)28-22-14-19(12-13-27-22)24-23(18-6-8-20(26)9-7-18)29-25(30(24)2)33-15-17-4-10-21(11-5-17)34(3)32/h4-14H,15H2,1-3H3,(H,27,28,31) | 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 | 5.85E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156822
(CHEMBL376486 | N-{4-[5-(4-fluorophenyl)-3-(3-morph...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CCCN1CCOCC1)-c1ccc(F)cc1 Show InChI InChI=1S/C24H28FN5O2S/c1-17(31)27-21-16-19(8-9-26-21)23-22(18-4-6-20(25)7-5-18)28-24(33-2)30(23)11-3-10-29-12-14-32-15-13-29/h4-9,16H,3,10-15H2,1-2H3,(H,26,27,31) | 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 | 6.28E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156843
(CHEMBL222227 | N-{4-[3-(2-acetylaminoethyl)-5-(4-f...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CCNC(C)=O)-c1ccc(F)cc1 Show InChI InChI=1S/C21H22FN5O2S/c1-13(28)23-10-11-27-20(16-8-9-24-18(12-16)25-14(2)29)19(26-21(27)30-3)15-4-6-17(22)7-5-15/h4-9,12H,10-11H2,1-3H3,(H,23,28)(H,24,25,29) | 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 | 7.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156838
(CHEMBL427104 | N-{4-[5-(4-fluorophenyl)-3-[2-(2-hy...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CCOCCO)-c1ccc(F)cc1 Show InChI InChI=1S/C21H23FN4O3S/c1-14(28)24-18-13-16(7-8-23-18)20-19(15-3-5-17(22)6-4-15)25-21(30-2)26(20)9-11-29-12-10-27/h3-8,13,27H,9-12H2,1-2H3,(H,23,24,28) | 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 | 8.48E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156849
(CHEMBL225174 | N-{4-[5-(4-fluorophenyl)-3-(2-hydro...)Show SMILES CSc1nc(c(-c2ccnc(NC(C)=O)c2)n1CC(C)O)-c1ccc(F)cc1 Show InChI InChI=1S/C20H21FN4O2S/c1-12(26)11-25-19(15-8-9-22-17(10-15)23-13(2)27)18(24-20(25)28-3)14-4-6-16(21)7-5-14/h4-10,12,26H,11H2,1-3H3,(H,22,23,27) | 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 | 8.69E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156823
(CHEMBL374485 | N-{4-[5-(4-fluorophenyl)-3-(3-hydro...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCCC(=O)N2CCOCC2)n1CCCO)-c1ccc(F)cc1 Show InChI InChI=1S/C26H30FN5O4S/c1-18(34)29-22-17-20(7-9-28-22)25-24(19-3-5-21(27)6-4-19)30-26(32(25)10-2-13-33)37-16-8-23(35)31-11-14-36-15-12-31/h3-7,9,17,33H,2,8,10-16H2,1H3,(H,28,29,34) | 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 | 9.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156846
(CHEMBL374530 | N-{4-[5-(4-fluorophenyl)-3-(2-hydro...)Show SMILES CC(O)Cn1c(SCc2ccc(cc2)S(C)=O)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C27H27FN4O3S2/c1-17(33)15-32-26(21-12-13-29-24(14-21)30-18(2)34)25(20-6-8-22(28)9-7-20)31-27(32)36-16-19-4-10-23(11-5-19)37(3)35/h4-14,17,33H,15-16H2,1-3H3,(H,29,30,34) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156848
(CHEMBL221825 | N-{4-[5-(4-fluorophenyl)-3-(3-metho...)Show SMILES COCCCn1c(SCCC(=O)N2CCOCC2)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C27H32FN5O4S/c1-19(34)30-23-18-21(8-10-29-23)26-25(20-4-6-22(28)7-5-20)31-27(33(26)11-3-14-36-2)38-17-9-24(35)32-12-15-37-16-13-32/h4-8,10,18H,3,9,11-17H2,1-2H3,(H,29,30,34) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156833
(4-[5-(2-acetylaminopyridin-4-yl)-4-(4-fluorophenyl...)Show SMILES CCOC(=O)N1CCC(CC1)n1c(SC)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C25H28FN5O3S/c1-4-34-25(33)30-13-10-20(11-14-30)31-23(18-9-12-27-21(15-18)28-16(2)32)22(29-24(31)35-3)17-5-7-19(26)8-6-17/h5-9,12,15,20H,4,10-11,13-14H2,1-3H3,(H,27,28,32) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156840
(CHEMBL222869 | N-{4-[3-(2-allyloxyethyl)-5-(4-fluo...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCc2ccc(cc2)S(C)=O)n1CCOCC=C)-c1ccc(F)cc1 Show InChI InChI=1S/C29H29FN4O3S2/c1-4-16-37-17-15-34-28(23-13-14-31-26(18-23)32-20(2)35)27(22-7-9-24(30)10-8-22)33-29(34)38-19-21-5-11-25(12-6-21)39(3)36/h4-14,18H,1,15-17,19H2,2-3H3,(H,31,32,35) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156824
(CHEMBL387358 | N-{4-[5-(4-fluorophenyl)-2-(4-methy...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCc2ccc(cc2)S(C)=O)n1C1CC(C)(C)NC(C)(C)C1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H38FN5O2S2/c1-21(40)36-28-17-24(15-16-35-28)30-29(23-9-11-25(34)12-10-23)37-31(42-20-22-7-13-27(14-8-22)43(6)41)39(30)26-18-32(2,3)38-33(4,5)19-26/h7-17,26,38H,18-20H2,1-6H3,(H,35,36,40) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156829
(CHEMBL443839 | N-{4-[5-(4-fluorophenyl)-2-(4-methy...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCc2ccc(cc2)S(C)=O)n1CCCN1CCOCC1)-c1ccc(F)cc1 Show InChI InChI=1S/C31H34FN5O3S2/c1-22(38)34-28-20-25(12-13-33-28)30-29(24-6-8-26(32)9-7-24)35-31(37(30)15-3-14-36-16-18-40-19-17-36)41-21-23-4-10-27(11-5-23)42(2)39/h4-13,20H,3,14-19,21H2,1-2H3,(H,33,34,38) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156830
(CHEMBL225100 | N-{4-[3-(2-acetylaminoethyl)-5-(4-f...)Show SMILES CC(=O)NCCn1c(SCc2ccc(cc2)S(C)=O)nc(c1-c1ccnc(NC(C)=O)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C28H28FN5O3S2/c1-18(35)30-14-15-34-27(22-12-13-31-25(16-22)32-19(2)36)26(21-6-8-23(29)9-7-21)33-28(34)38-17-20-4-10-24(11-5-20)39(3)37/h4-13,16H,14-15,17H2,1-3H3,(H,30,35)(H,31,32,36) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50156818
(CHEMBL388755 | N-{4-[5-(4-fluorophenyl)-3-[2-(2-hy...)Show SMILES CC(=O)Nc1cc(ccn1)-c1c(nc(SCc2ccc(cc2)S(C)=O)n1CCOCCO)-c1ccc(F)cc1 Show InChI InChI=1S/C28H29FN4O4S2/c1-19(35)31-25-17-22(11-12-30-25)27-26(21-5-7-23(29)8-6-21)32-28(33(27)13-15-37-16-14-34)38-18-20-3-9-24(10-4-20)39(2)36/h3-12,17,34H,13-16,18H2,1-2H3,(H,30,31,35) | 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 | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description Inhibition of mitogen-activated protein kinase p38 alpha |
J Med Chem 47: 6311-25 (2004)
Article DOI: 10.1021/jm0496584 BindingDB Entry DOI: 10.7270/Q2N8799P |
More data for this Ligand-Target Pair | |