BDBM50240039 CHEBI:16794::CHEMBL569713

SMILES CN1[C@H]2C[C@@H](C[C@@H]1[C@H]1O[C@@H]21)OC(=O)[C@H](CO)c1ccccc1

InChI Key InChIKey=STECJAGHUSJQJN-FWXGHANASA-N

Data  2 KI  1 IC50

PDB links: 1 PDB ID matches this monomer.

  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 = 50240039   

TargetMuscarinic acetylcholine receptor DM1(Drosophila melanogaster)
University Of California

Curated by ChEMBL
LigandPNGBDBM50240039(CHEBI:16794 | CHEMBL569713)
Affinity DataKi:  0.700nMAssay Description:Displacement of [3H]AF-DX 384 from Drosophila melanogaster mAChR by scintillation countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMuscarinic acetylcholine receptor DM1(Drosophila melanogaster)
University Of California

Curated by ChEMBL
LigandPNGBDBM50240039(CHEBI:16794 | CHEMBL569713)
Affinity DataKi:  1.10nMAssay Description:Displacement of [3H]QNB from Drosophila melanogaster mAChR by scintillation countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBile salt export pump(Homo sapiens (Human))
Astrazeneca

Curated by ChEMBL
LigandPNGBDBM50240039(CHEBI:16794 | CHEMBL569713)
Affinity DataIC50: >1.00E+6nMAssay Description:Inhibition of human BSEP expressed in baculovirus transfected fall armyworm Sf21 cell membranes vesicles assessed as reduction in ATP-dependent [3H]-...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed