BDBM50130894 CHEMBL3632627

SMILES [H][C@@]12CC[C@@]3(C)[C@@]([H])(CCC4=C(CC[C@]34C)[C@H](C)C[C@H](O)[C@H](O)C(C)=C)[C@@]1(C)CCC(=O)C2(C)C

InChI Key InChIKey=KSXSGXZOFUHSPA-UHFFFAOYSA-N

Data  1 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 2 hits for monomerid = 50130894   

TargetCocaine esterase(Human)
Liaoning University of Traditional Chinese Medicine

Curated by ChEMBL
LigandPNGBDBM50130894(CHEMBL3632627)
Affinity DataIC50: 1.74E+4nMAssay Description:Inhibition of human carboxylesterase 2 using 4-benzoyl-N-butyl-1,8-naphthalimide as substrate by fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2016
Entry Details Article
PubMed
TargetBile acid receptor(Human)
Dalian Medical University

Curated by ChEMBL
LigandPNGBDBM50130894(CHEMBL3632627)
Affinity DataEC50:  3.03E+3nMAssay Description:Transactivation of FXR (unknown origin) transfected in HepG2 cells co-expressing pBSEP/pGL4.74 incubated for 24 hrs by luciferase reporter gene assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/25/2021
Entry Details Article
PubMed