BDBM50254969 CHEMBL518142::[4'-((3R,5S)-3,5-Dimethyl-piperazin-1-ylmethyl)-biphenyl-2-yl]-[4-(4-fluoro-phenoxy)-piperidin-1-yl]-methanone

SMILES C[C@H]1CN(Cc2ccc(cc2)-c2ccccc2C(=O)N2CCC(CC2)Oc2ccc(F)cc2)C[C@@H](C)N1

InChI Key InChIKey=VRZJRRFRFQRESG-UHFFFAOYSA-N

Data  2 IC50  1 EC50

  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 = 50254969   

TargetCytochrome P450 3A4(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50254969([4'-((3R,5S)-3,5-Dimethyl-piperazin-1-ylmethyl)-bi...)
Affinity DataIC50: 8.40E+3nMAssay Description:Inhibition of CYP3A4 using diethoxyfluorescein substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50254969([4'-((3R,5S)-3,5-Dimethyl-piperazin-1-ylmethyl)-bi...)
Affinity DataIC50: 1.40E+4nMAssay Description:Inhibition of CYP3A4 using phenyl-piperazinyl-methyl-benzyl-resofurin substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed
TargetMotilin receptor(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50254969([4'-((3R,5S)-3,5-Dimethyl-piperazin-1-ylmethyl)-bi...)
Affinity DataEC50:  63.1nMAssay Description:Agonist activity at human recombinant motilin receptor expressed in HEK293 cells by FLIPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed