BDBM50235617 CHEMBL4083451

SMILES CC(CC1=N[C@@H](CCCCN2C[C@H](Cc3ccccc3)N(CCc3ccccc3)C2=S)CN1)c1ccccc1

InChI Key InChIKey=QNKDXBRNEIOPHT-HUSUQQPPSA-N

Data  3 IC50

  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 = 50235617   

TargetNuclear receptor ROR-beta(Rattus norvegicus)
Torrey Pines Institute For Molecular Studies

Curated by ChEMBL
LigandPNGBDBM50235617(CHEMBL4083451)
Affinity DataIC50:  1.09E+4nMAssay Description:Binding affinity against 5-hydroxytryptamine 3 receptor using [3H]BRL-43694 as radioligand in rat posterior cortexMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNuclear receptor ROR-gamma(Mus musculus)
Torrey Pines Institute For Molecular Studies

Curated by ChEMBL
LigandPNGBDBM50235617(CHEMBL4083451)
Affinity DataIC50:  6.50E+3nMAssay Description:Antagonist activity at mouse Gal4-fused DBD RORgamma LBD (Pro-261-end) expressed in TRex-CHOK1 cells after 20 hrs by luciferase reporter gene assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetNuclear receptor ROR-alpha(Homo sapiens (Human))
Torrey Pines Institute For Molecular Studies

Curated by ChEMBL
LigandPNGBDBM50235617(CHEMBL4083451)
Affinity DataIC50:  7.50E+3nMAssay Description:Antagonist activity at human Gal4-fused DBD RORalpha LBD (Pro-211-end) expressed in TRex-CHOK1 cells after 20 hrs by luciferase reporter gene assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed