BDBM50531803 CHEMBL4531596

SMILES CC\1=C(c2ccccc2/C1=C\c3ccc(cc3)C(C)C)CCc4[nH]nnn4

InChI Key InChIKey=QSWFMFNUTKAURC-UHFFFAOYSA-N

Data  1 IC50  1 Kd

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50531803   

TargetRetinoic acid receptor RXR-alpha(Human)
Vitae Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50531803(CHEMBL4531596)
Affinity DataIC50: 1.00E+4nMAssay Description:Binding affinity to human GST-tagged RXRalpha ligand binding domain (223 to 462 residues) expressed in Escherichia coli BL21 assessed as inhibition o...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/2/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetRetinoic acid receptor RXR-alpha(Human)
Vitae Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50531803(CHEMBL4531596)
Affinity DataKd:  2.05E+3nMAssay Description:Inhibition of 9-cis-retinoic acid competition binding to RXRalpha LBD (unknown origin) by fluorescence quenching methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/27/2021
Entry Details Article
PubMedPDB3D3D Structure (crystal)