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BDBM50134617 CHEMBL3746623

SMILES: Cn1c2nc(NCc3ccccn3)ncc2cc(Oc2ccc(F)cc2F)c1=O

InChI Key: InChIKey=GDPNFRQTIUPZRF-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50134617   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
c-Jun N-terminal kinase, JNK


(Homo sapiens (Human))
BDBM50134617
PNG
(CHEMBL3746623)
Show SMILES Cn1c2nc(NCc3ccccn3)ncc2cc(Oc2ccc(F)cc2F)c1=O
Show InChI InChI=1S/C20H15F2N5O2/c1-27-18-12(10-24-20(26-18)25-11-14-4-2-3-7-23-14)8-17(19(27)28)29-16-6-5-13(21)9-15(16)22/h2-10H,11H2,1H3,(H,24,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.30E+4n/an/an/an/an/an/a



Semmelweis University

Curated by ChEMBL


Assay Description
Inhibition of JNK1 (unknown origin)


Bioorg Med Chem Lett 26: 424-8 (2016)


Article DOI: 10.1016/j.bmcl.2015.11.099
BindingDB Entry DOI: 10.7270/Q24T6M6J
More data for this
Ligand-Target Pair