Found 12 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)) | 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 | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha MAPK by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM15237
(4-[1-(cyclopropylmethyl)-4-(4-fluorophenyl)-1H-imi...)Show InChI InChI=1S/C18H16FN3/c19-16-5-3-14(4-6-16)17-18(15-7-9-20-10-8-15)22(12-21-17)11-13-1-2-13/h3-10,12-13H,1-2,11H2 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
MMDB
Article
PubMed
| n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha MAPK by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair |
3D Structure (docked) |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50206421
(3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...)Show InChI InChI=1S/C17H15FN2O/c1-11(2)17-15(12-7-9-19-10-8-12)16(20-21-17)13-3-5-14(18)6-4-13/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
| Article
PubMed
| n/a | n/a | 450 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha MAPK by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 10
(Homo sapiens (Human)) | BDBM50206421
(3-(4-fluorophenyl)-5-isopropyl-4-(pyridin-4-yl)iso...)Show InChI InChI=1S/C17H15FN2O/c1-11(2)17-15(12-7-9-19-10-8-12)16(20-21-17)13-3-5-14(18)6-4-13/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
| Article
PubMed
| n/a | n/a | 540 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description
Inhibition of JNK3 by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 10
(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
| Article
PubMed
| n/a | n/a | 790 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description
Inhibition of JNK3 by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50206422
(3-(4-fluorophenyl)-4-(pyridin-4-yl)quinolin-2(1H)-...)Show InChI InChI=1S/C20H13FN2O/c21-15-7-5-13(6-8-15)19-18(14-9-11-22-12-10-14)16-3-1-2-4-17(16)23-20(19)24/h1-12H,(H,23,24) | 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 | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha MAPK by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50206423
(4-(5-(4-fluorophenyl)-3-isopropylisoxazol-4-yl)pyr...)Show InChI InChI=1S/C17H15FN2O/c1-11(2)16-15(12-7-9-19-10-8-12)17(21-20-16)13-3-5-14(18)6-4-13/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
| Article
PubMed
| n/a | n/a | 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha MAPK by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 10
(Homo sapiens (Human)) | BDBM50206423
(4-(5-(4-fluorophenyl)-3-isopropylisoxazol-4-yl)pyr...)Show InChI InChI=1S/C17H15FN2O/c1-11(2)16-15(12-7-9-19-10-8-12)17(21-20-16)13-3-5-14(18)6-4-13/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
| Article
PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description
Inhibition of JNK3 by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50114691
(2-(2-(methylsulfinyl)benzylthio)-5-(4-fluorophenyl...)Show SMILES CS(=O)c1ccccc1CSc1ncc(-c2ccc(F)cc2)c(n1)-c1ccncc1 Show InChI InChI=1S/C23H18FN3OS2/c1-30(28)21-5-3-2-4-18(21)15-29-23-26-14-20(16-6-8-19(24)9-7-16)22(27-23)17-10-12-25-13-11-17/h2-14H,15H2,1H3 | 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 | 5.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description
Inhibition of p38alpha MAPK by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 10
(Homo sapiens (Human)) | BDBM50206420
(4-(4-fluorophenyl)-3-pyridin-4-ylquinoline-2(1H)-o...)Show SMILES Fc1ccc(cc1)-c1c(-c2ccncc2)c(=O)[nH]c2ccccc12 Show InChI InChI=1S/C20H13FN2O/c21-15-7-5-13(6-8-15)18-16-3-1-2-4-17(16)23-20(24)19(18)14-9-11-22-12-10-14/h1-12H,(H,23,24) | 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 JNK3 by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 14
(Homo sapiens (Human)) | BDBM50206420
(4-(4-fluorophenyl)-3-pyridin-4-ylquinoline-2(1H)-o...)Show SMILES Fc1ccc(cc1)-c1c(-c2ccncc2)c(=O)[nH]c2ccccc12 Show InChI InChI=1S/C20H13FN2O/c21-15-7-5-13(6-8-15)18-16-3-1-2-4-17(16)23-20(24)19(18)14-9-11-22-12-10-14/h1-12H,(H,23,24) | 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 p38alpha MAPK by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 10
(Homo sapiens (Human)) | BDBM50114691
(2-(2-(methylsulfinyl)benzylthio)-5-(4-fluorophenyl...)Show SMILES CS(=O)c1ccccc1CSc1ncc(-c2ccc(F)cc2)c(n1)-c1ccncc1 Show InChI InChI=1S/C23H18FN3OS2/c1-30(28)21-5-3-2-4-18(21)15-29-23-26-14-20(16-6-8-19(24)9-7-16)22(27-23)17-10-12-25-13-11-17/h2-14H,15H2,1H3 | 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 | 2.85E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Eberhard-Karls-University Tübingen
Curated by ChEMBL
| Assay Description
Inhibition of JNK3 by non-radioactive immunosorbent assay |
J Med Chem 50: 1213-21 (2007)
Article DOI: 10.1021/jm061097o
BindingDB Entry DOI: 10.7270/Q2QZ29NS |
More data for this
Ligand-Target Pair | |
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