BDBM50019333 CHEMBL3289432

SMILES Cc1nc(C)c(s1)-c1cc[nH]n1

InChI Key InChIKey=XZLKZEOPTRHRHG-UHFFFAOYSA-N

Data  1 KI  1 IC50  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50019333   

TargetLanosterol synthase(Rattus norvegicus)
F. Hoffmann-La Roche

Curated by ChEMBL
LigandPNGBDBM50019333(CHEMBL3289432)
Affinity DataIC50:  1.60E+4nMAssay Description:Inhibition of recombinant wild-type human COMT expressed in Escherichia coli BL21 using 4-nitrocatechol-Alexa488 as substrate in presence of cofactor...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed