BDBM50338979 CHEMBL1685072::neocalycopteron

SMILES COC1=C(OC)[C@]2(OC)c3c(O[C@@]22O[C@H](CC=C2C1=O)c1ccccc1)c1[C@@H](O)C[C@@H](Oc1c(OC)c3OC)c1ccccc1

InChI Key InChIKey=CAPJLGPKGOVWIU-UHFFFAOYSA-N

Data  3 IC50

  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 = 50338979   

LigandPNGBDBM50338979(neocalycopteron | CHEMBL1685072)
Affinity DataIC50: 1.50E+4nMAssay Description:Inhibition of BCRP expressed in MCF-7 MX cells using Hoechst 33342 stainingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed
LigandPNGBDBM50338979(neocalycopteron | CHEMBL1685072)
Affinity DataIC50: 1.10E+4nMAssay Description:Inhibition of BCRP expressed in MDCK cells using Hoechst 33342 stainingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed
TargetATP-dependent translocase ABCB1(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50338979(neocalycopteron | CHEMBL1685072)
Affinity DataIC50: 8.00E+3nMAssay Description:Inhibition of MDR1 expressed in MDCK cells using rhodamine 123 staining by flow cytometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2011
Entry Details Article
PubMed