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BDBM50086258 CHEMBL3425842

SMILES: OCCNc1snc2cc(cnc12)-c1ccsc1

InChI Key: InChIKey=ZMJZPQIYRUXZIX-UHFFFAOYSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50086258   
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
Serine/threonine-protein kinase GAK


(Homo sapiens (Human))
BDBM50086258
PNG
(CHEMBL3425842)
Show SMILES OCCNc1snc2cc(cnc12)-c1ccsc1
Show InChI InChI=1S/C12H11N3OS2/c16-3-2-13-12-11-10(15-18-12)5-9(6-14-11)8-1-4-17-7-8/h1,4-7,13,16H,2-3H2
PDB
MMDB

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Article
PubMed
n/an/an/a 300n/an/an/an/an/a



KU Leuven

Curated by ChEMBL


Assay Description
Binding affinity to human GAK fused to T7 bacteriophage expressed in Escherichia coli BL21 after 1 hr by qPCR analysis


J Med Chem 58: 3393-410 (2015)


Article DOI: 10.1021/jm501759m
BindingDB Entry DOI: 10.7270/Q2XD13D4
More data for this
Ligand-Target Pair