Found 3 hits in this display 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 8
(Homo sapiens (Human)) | BDBM50194881
(CHEMBL220749 | N-(4-(methylsulfonyl)benzyl)-4-amin...)Show SMILES CS(=O)(=O)c1ccc(CNC(=O)c2cc(N)c(C#N)c(NCc3ccccc3)n2)cc1 Show InChI InChI=1S/C22H21N5O3S/c1-31(29,30)17-9-7-16(8-10-17)14-26-22(28)20-11-19(24)18(12-23)21(27-20)25-13-15-5-3-2-4-6-15/h2-11H,13-14H2,1H3,(H,26,28)(H3,24,25,27) | 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 | 820 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description Inhibition of JNK1 by ATF2 phosphorylation assay |
Bioorg Med Chem Lett 16: 5723-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.097 BindingDB Entry DOI: 10.7270/Q28G8KBG |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 8
(Homo sapiens (Human)) | BDBM50194881
(CHEMBL220749 | N-(4-(methylsulfonyl)benzyl)-4-amin...)Show SMILES CS(=O)(=O)c1ccc(CNC(=O)c2cc(N)c(C#N)c(NCc3ccccc3)n2)cc1 Show InChI InChI=1S/C22H21N5O3S/c1-31(29,30)17-9-7-16(8-10-17)14-26-22(28)20-11-19(24)18(12-23)21(27-20)25-13-15-5-3-2-4-6-15/h2-11H,13-14H2,1H3,(H,26,28)(H3,24,25,27) | 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 | 820 | n/a | n/a | n/a | n/a | n/a | n/a |
Chinese Academy of Sciences
Curated by ChEMBL
| Assay Description Inhibition of JNK1 |
Eur J Med Chem 43: 604-13 (2008)
Article DOI: 10.1016/j.ejmech.2007.04.020 BindingDB Entry DOI: 10.7270/Q2T43V9Z |
More data for this Ligand-Target Pair | |
Mitogen-activated protein kinase 9
(Homo sapiens (Human)) | BDBM50194881
(CHEMBL220749 | N-(4-(methylsulfonyl)benzyl)-4-amin...)Show SMILES CS(=O)(=O)c1ccc(CNC(=O)c2cc(N)c(C#N)c(NCc3ccccc3)n2)cc1 Show InChI InChI=1S/C22H21N5O3S/c1-31(29,30)17-9-7-16(8-10-17)14-26-22(28)20-11-19(24)18(12-23)21(27-20)25-13-15-5-3-2-4-6-15/h2-11H,13-14H2,1H3,(H,26,28)(H3,24,25,27) | 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 | 4.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott Laboratories
Curated by ChEMBL
| Assay Description Inhibition of JNK2 by ATF2 phosphorylation assay |
Bioorg Med Chem Lett 16: 5723-30 (2006)
Article DOI: 10.1016/j.bmcl.2006.08.097 BindingDB Entry DOI: 10.7270/Q28G8KBG |
More data for this Ligand-Target Pair | |