BDBM50392986 CHEMBL2152386
SMILES: COC(=O)c1c(Cc2ccc(cc2)C(=O)NCC(C)(C)O)c(=O)c2cccnc2n1-c1ccccc1
InChI Key: InChIKey=HUFCSXPSQSVFBV-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50392986 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/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)) | BDBM50392986
(CHEMBL2152386)Show SMILES COC(=O)c1c(Cc2ccc(cc2)C(=O)NCC(C)(C)O)c(=O)c2cccnc2n1-c1ccccc1 Show InChI InChI=1S/C28H27N3O5/c1-28(2,35)17-30-26(33)19-13-11-18(12-14-19)16-22-23(27(34)36-3)31(20-8-5-4-6-9-20)25-21(24(22)32)10-7-15-29-25/h4-15,35H,16-17H2,1-3H3,(H,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 | n/a | n/a | 9.90E+3 | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of JNK1-mediated c-jun phosphorylation in TNF-alpha stimulated human HK-2 cells after 30 mins by TR-FRET assay |
ACS Med Chem Lett 3: 764-768 (2012)
Article DOI: 10.1021/ml300175c
BindingDB Entry DOI: 10.7270/Q22808P8 |
More data for this
Ligand-Target Pair | |
Mitogen-activated protein kinase 8
(Homo sapiens (Human)) | BDBM50392986
(CHEMBL2152386)Show SMILES COC(=O)c1c(Cc2ccc(cc2)C(=O)NCC(C)(C)O)c(=O)c2cccnc2n1-c1ccccc1 Show InChI InChI=1S/C28H27N3O5/c1-28(2,35)17-30-26(33)19-13-11-18(12-14-19)16-22-23(27(34)36-3)31(20-8-5-4-6-9-20)25-21(24(22)32)10-7-15-29-25/h4-15,35H,16-17H2,1-3H3,(H,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 | 44 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of JNK1 after 30 mins by TR-FRET assay |
ACS Med Chem Lett 3: 764-768 (2012)
Article DOI: 10.1021/ml300175c
BindingDB Entry DOI: 10.7270/Q22808P8 |
More data for this
Ligand-Target Pair | |
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