BDBM50650275 CHEMBL5631076

SMILES C[C@H](CCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)c1ccc2c(-c3ccc(C(=O)O)cc3)nn(C(=O)c3c(Cl)cccc3C(F)(F)F)c2c1)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI Key

  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 = 50650275   

TargetNuclear receptor ROR-gamma(Human)
Fudan University

Curated by ChEMBL
LigandPNGBDBM50650275(CHEMBL5631076)
Affinity DataIC50: 5.90nMAssay Description:Inverse agonist activity at human N-terminal his 6 tagged RORgammat LBD (265 to 518 residues) expressed in Escherichia coli BL21(DE3) cells incubated...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetNuclear receptor ROR-alpha(Human)
Fudan University

Curated by ChEMBL
LigandPNGBDBM50650275(CHEMBL5631076)
Affinity DataIC50: 4.00E+3nMAssay Description:Inverse agonist activity at human his 6 tagged RORalpha LBD incubated for 60 mins by TR-FRET assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed
TargetPeroxisome proliferator-activated receptor gamma(Human)
Fudan University

Curated by ChEMBL
LigandPNGBDBM50650275(CHEMBL5631076)
Affinity DataIC50: 1.00E+5nMAssay Description:Inverse agonist activity at human his 6 tagged PPARgammaLBD incubated for 60 mins by TR-FRET assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMed