BDBM50017849 CHEMBL169679::N-Adamantan-1-yl-2-chloro-4,5-dihydroxy-benzamide

SMILES Oc1cc(Cl)c(cc1O)C(=O)NC12CC3CC(CC(C3)C1)C2

InChI Key InChIKey=XMKRFHKZKCPMEJ-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50017849   

TargetCatechol O-methyltransferase(Rattus norvegicus (Rat))
Orion

Curated by ChEMBL
LigandPNGBDBM50017849(CHEMBL169679 | N-Adamantan-1-yl-2-chloro-4,5-dihyd...)
Affinity DataIC50:  2.70E+3nMAssay Description:In vitro inhibitory activity against catechol O-methyltransferase of rat brain using 3,4-dihydroxybenzoic acid as the substrate.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed