BDBM50082822 CHEMBL424494::methyl 4-(3,4-difluorophenyl)-6-methyl-2-oxo-3-[3-spiro[2,3-dihydro-1H-indene-1,4'-(hexahydropyridine)]-1-ylpropylcarbamoyl]-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

SMILES COC(=O)C1=C(C)NC(=O)N(C1c1ccc(F)c(F)c1)C(=O)NCCCN1CCC2(CCc3ccccc23)CC1

InChI Key InChIKey=VOWPOPUYBMDWNA-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50082822   

TargetAlpha-1A adrenergic receptor(Homo sapiens (Human))
Synaptic Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM50082822(CHEMBL424494 | methyl 4-(3,4-difluorophenyl)-6-met...)
Affinity DataKi:  1.10nMAssay Description:In vitro binding affinity against alpha-1A adrenergic receptor of human liver microsomesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAlpha-1D adrenergic receptor(Homo sapiens (Human))
Synaptic Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM50082822(CHEMBL424494 | methyl 4-(3,4-difluorophenyl)-6-met...)
Affinity DataKi:  230nMAssay Description:In vitro binding affinity against alpha-1D adrenergic receptor of human liver microsomes.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAlpha-1B adrenergic receptor(Homo sapiens (Human))
Synaptic Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM50082822(CHEMBL424494 | methyl 4-(3,4-difluorophenyl)-6-met...)
Affinity DataKi:  410nMAssay Description:In vitro binding affinity against Alpha-1B adrenergic receptor of human liver microsomes.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed