BDBM510573 US11078186, Example 27::rac-2-(4-((3S,4S)-1-benzyl-4-methyl-4-phenylpyrrolidin-3-yl)phenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol

SMILES C[C@@]1(CN(Cc2ccccc2)C[C@H]1c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)c1ccccc1

InChI Key InChIKey=AKLFLVCBPUPSAL-UHFFFAOYSA-N

Data  1 IC50  2 EC50

  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 3 hits for monomerid = 510573   

TargetNuclear receptor subfamily 1 group I member 2(Human)
Bristol Myers Squibb

Curated by ChEMBL
LigandPNGBDBM510573(rac-2-(4-((3S,4S)-1-benzyl-4-methyl-4-phenylpyrrol...)
Affinity DataEC50:  321nMAssay Description:Activation of PXR (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed
TargetNuclear receptor ROR-gamma [262-507](Human)
Bristol-Myers Squibb

US Patent
LigandPNGBDBM510573(rac-2-(4-((3S,4S)-1-benzyl-4-methyl-4-phenylpyrrol...)
Affinity DataIC50: 691nMAssay Description:The binding of potential ligands to RORγ is measured by competition with [3H]25-hydroxycholesterol (Perkin Elmer NET674250UC) using a scintillat...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/16/2022
Entry Details
US Patent

TargetNuclear receptor ROR-gamma(Human)
Bristol Myers Squibb

Curated by ChEMBL
LigandPNGBDBM510573(rac-2-(4-((3S,4S)-1-benzyl-4-methyl-4-phenylpyrrol...)
Affinity DataEC50:  1.92E+3nMAssay Description:Inverse agonist activity at RORgammat (unknown origin) expressed in Jurkat cells by reporter assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed