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BDBM50040479 CHEMBL3360629

SMILES: O=C(Cn1ncc2c1c1ccccc1oc2=O)Nc1ccc2OCCOc2c1

InChI Key: InChIKey=FMCHJJRXXRRGPE-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50040479   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Inosine-5-monophosphate dehydrogenase (IMPDH)


(Cryptosporidium parvum)
BDBM50040479
PNG
(CHEMBL3360629)
Show SMILES O=C(Cn1ncc2c1c1ccccc1oc2=O)Nc1ccc2OCCOc2c1
Show InChI InChI=1S/C20H15N3O5/c24-18(22-12-5-6-16-17(9-12)27-8-7-26-16)11-23-19-13-3-1-2-4-15(13)28-20(25)14(19)10-21-23/h1-6,9-10H,7-8,11H2,(H,22,24)
PDB
MMDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 190n/an/an/an/an/an/a



University of Houston

Curated by ChEMBL


Assay Description
Inhibition of Cryptosporidium parvum IMPDH assessed as reduction in NADH production


J Med Chem 57: 10544-50 (2014)


Article DOI: 10.1021/jm501527z
BindingDB Entry DOI: 10.7270/Q2XS5X1F
More data for this
Ligand-Target Pair