BDBM50149218 Benzo[b]thiophene-2-carboxylic acid::CHEMBL312607

SMILES OC(=O)c1cc2ccccc2s1

InChI Key InChIKey=DYSJMQABFPKAQM-UHFFFAOYSA-N

Data  1 KI  1 IC50  1 Kd

PDB links: 3 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50149218   

TargetCytochrome P450 2A6(Homo sapiens (Human))
University Of Eastern Finland

Curated by ChEMBL
LigandPNGBDBM50149218(Benzo[b]thiophene-2-carboxylic acid | CHEMBL312607)
Affinity DataIC50: >1.00E+5nMAssay Description:Inhibition of CYP2A6 in human liver microsomes assessed as inhibition of coumarin 7-hydroxylation after 10 mins by plate readerMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed