BDBM29097 dibenzothiazepine, 12c

SMILES FC1(F)CCN(CC1)C1=Nc2cc(ccc2Sc2ccccc12)C(=O)NCc1cccc(Cl)c1

InChI Key InChIKey=GHLZMFQTCPAANB-UHFFFAOYSA-N

Data  2 KI

  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 2 hits for monomerid = 29097   

TargetCannabinoid receptor 1(Homo sapiens (Human))
Acadia Pharmaceuticals

LigandPNGBDBM29097(dibenzothiazepine, 12c)
Affinity DataKi:  0.790nM ΔG°:  -12.3kcal/molepH: 7.2 T: 2°CAssay Description:IC50 values for test compounds were determined from nonlinear regression analysis of data collected from ligand displacement experiments. The inhibit...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCannabinoid receptor 2(Homo sapiens (Human))
Acadia Pharmaceuticals

LigandPNGBDBM29097(dibenzothiazepine, 12c)
Affinity DataKi:  1.26E+3nM ΔG°:  -7.96kcal/molepH: 7.2 T: 2°CAssay Description:IC50 values for test compounds were determined from nonlinear regression analysis of data collected from ligand displacement experiments. The inhibit...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed