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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Inosine-5'-monophosphate dehydrogenase 1/2' and Ligand = 'BDBM50220674'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Inosine-5'-monophosphate dehydrogenase 1/2


(Homo sapiens (Human))
BDBM50220674
PNG
(CHEMBL44826)
Show SMILES COc1ccc(NC(=O)C(=O)NC(C)(C)C)cc1OC
Show InChI InChI=1S/C14H20N2O4/c1-14(2,3)16-13(18)12(17)15-9-6-7-10(19-4)11(8-9)20-5/h6-8H,1-5H3,(H,15,17)(H,16,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2.10E+4n/an/an/an/an/an/a



Roche Discovery Welwyn

Curated by ChEMBL


Assay Description
Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase


Bioorg Med Chem Lett 13: 1691-4 (2003)


BindingDB Entry DOI: 10.7270/Q21N83B7
More data for this
Ligand-Target Pair