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SMILES: COc1cc(Nc2ncc(o2)-c2ccccc2NC(C)=O)ccc1-c1cnco1

InChI Key: InChIKey=RQAPGWNZVOGCLB-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50113214   
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
Inosine-5'-monophosphate dehydrogenase 2


(Homo sapiens (Human))
BDBM50113214
PNG
(CHEMBL65826 | N-{2-[2-(3-Methoxy-4-oxazol-5-yl-phe...)
Show SMILES COc1cc(Nc2ncc(o2)-c2ccccc2NC(C)=O)ccc1-c1cnco1
Show InChI InChI=1S/C21H18N4O4/c1-13(26)24-17-6-4-3-5-15(17)20-11-23-21(29-20)25-14-7-8-16(18(9-14)27-2)19-10-22-12-28-19/h3-12H,1-2H3,(H,23,25)(H,24,26)
PDB
MMDB

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PubMed
n/an/a 30n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human inosine-5'-monophosphate dehydrogenase 2


J Med Chem 45: 2127-30 (2002)


BindingDB Entry DOI: 10.7270/Q21R6R71
More data for this
Ligand-Target Pair