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BDBM50169966 (2Z)-1,3-benzothiazol-2(3H)-ylidene(2-chloropyrimidin-4-yl)acetonitrile::CHEMBL364757

SMILES: Clc1nccc(n1)C(C#N)c1nc2ccccc2s1

InChI Key: InChIKey=QVMKLKBODZHJDK-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50169966   
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 3


(Rattus norvegicus)
BDBM50169966
PNG
((2Z)-1,3-benzothiazol-2(3H)-ylidene(2-chloropyrimi...)
Show SMILES Clc1nccc(n1)C(C#N)c1nc2ccccc2s1
Show InChI InChI=1S/C13H7ClN4S/c14-13-16-6-5-9(18-13)8(7-15)12-17-10-3-1-2-4-11(10)19-12/h1-6,8H
PDB
MMDB

KEGG

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Article
PubMed
n/an/a 250n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of rat c-Jun N-terminal kinase 3


J Med Chem 48: 4596-607 (2005)


Article DOI: 10.1021/jm0310986
BindingDB Entry DOI: 10.7270/Q2K9389G
More data for this
Ligand-Target Pair