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SMILES: COC(=O)C(C)(C)NC(=O)C(=O)Nc1ccc(-c2cnco2)c(OC)c1

InChI Key: InChIKey=MVUGQWXQRSMXPE-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50112561   
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))
BDBM50112561
PNG
(2-[(3-Methoxy-4-oxazol-5-yl-phenylaminooxalyl)-ami...)
Show SMILES COC(=O)C(C)(C)NC(=O)C(=O)Nc1ccc(-c2cnco2)c(OC)c1
Show InChI InChI=1S/C17H19N3O6/c1-17(2,16(23)25-4)20-15(22)14(21)19-10-5-6-11(12(7-10)24-3)13-8-18-9-26-13/h5-9H,1-4H3,(H,19,21)(H,20,22)
PDB
MMDB

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PubMed
n/an/a 74n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


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


Bioorg Med Chem Lett 12: 1323-6 (2002)


BindingDB Entry DOI: 10.7270/Q2NG4PX7
More data for this
Ligand-Target Pair