BDBM50090328 (R)-4-(3,4-Difluoro-phenyl)-1,2-dimethyl-6-oxo-1,4,5,6-tetrahydro-pyridine-3-carboxylic acid {3-[4-(2-cyano-4-fluoro-phenyl)-piperidin-1-yl]-propyl}-amide::CHEMBL288772

SMILES CN1C(=O)C[C@@H](C(C(=O)NCCCN2CCC(CC2)c2ccc(F)cc2C#N)=C1C)c1ccc(F)c(F)c1

InChI Key InChIKey=DLMPCEBSXNLTAT-XMMPIXPASA-N

Data  7 KI

  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 7 hits for monomerid = 50090328   

TargetAlpha-1A adrenergic receptor(Homo sapiens (Human))
Merck

Curated by ChEMBL
LigandPNGBDBM50090328((R)-4-(3,4-Difluoro-phenyl)-1,2-dimethyl-6-oxo-1,4...)
Affinity DataKi:  0.800nMAssay Description:In vitro antagonism at Alpha-1A adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAlpha-2B adrenergic receptor(Homo sapiens (Human))
Merck

Curated by ChEMBL
LigandPNGBDBM50090328((R)-4-(3,4-Difluoro-phenyl)-1,2-dimethyl-6-oxo-1,4...)
Affinity DataKi:  288nMAssay Description:In vivo inhibitory effect of the compound against alpha-2b Adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAlpha-1B adrenergic receptor(Homo sapiens (Human))
Merck

Curated by ChEMBL
LigandPNGBDBM50090328((R)-4-(3,4-Difluoro-phenyl)-1,2-dimethyl-6-oxo-1,4...)
Affinity DataKi:  366nMAssay Description:In vitro antagonism at Alpha-1B adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHistamine H1 receptor(Homo sapiens (Human))
Merck

Curated by ChEMBL
LigandPNGBDBM50090328((R)-4-(3,4-Difluoro-phenyl)-1,2-dimethyl-6-oxo-1,4...)
Affinity DataKi:  398nMAssay Description:Selectivity screen against human Histamine H1 receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAlpha-1D adrenergic receptor(Homo sapiens (Human))
Merck

Curated by ChEMBL
LigandPNGBDBM50090328((R)-4-(3,4-Difluoro-phenyl)-1,2-dimethyl-6-oxo-1,4...)
Affinity DataKi:  590nMAssay Description:In vitro antagonism at Alpha-1D adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAlpha-2C adrenergic receptor(Homo sapiens (Human))
Merck

Curated by ChEMBL
LigandPNGBDBM50090328((R)-4-(3,4-Difluoro-phenyl)-1,2-dimethyl-6-oxo-1,4...)
Affinity DataKi:  3.85E+3nMAssay Description:In vivo inhibitory effect of the compound against Alpha-2C adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAlpha-2A adrenergic receptor(Homo sapiens (Human))
Merck

Curated by ChEMBL
LigandPNGBDBM50090328((R)-4-(3,4-Difluoro-phenyl)-1,2-dimethyl-6-oxo-1,4...)
Affinity DataKi:  4.52E+3nMAssay Description:In vivo inhibitory effect against Alpha-2A adrenergic receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed