BDBM50179194 ((2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl 10-((8R,9S,13S,14S,16S,17S)-3,17-dihydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-16-yl)decanoate::5'-O-{10-[3',17'beta-dihydroxy-1',3',5'(10')-estratrien-16'beta-yl]-decanoyl} adenosine::CHEMBL372560

SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1C[C@H](CCCCCCCCCC(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc3c(N)ncnc13)[C@@H]2O

InChI Key InChIKey=ZSPKKSHQSXRCOB-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50179194   

Target17-beta-hydroxysteroid dehydrogenase type 1(Human)
Chuq-Pavillon Chul and Université

Curated by ChEMBL
LigandPNGBDBM50179194(5'-O-{10-[3',17'beta-dihydroxy-1',3',5'(10')-estra...)
Affinity DataIC50: 140nMAssay Description:Inhibitory activity against type 1 17beta-HSD expressed in transfected HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target17-beta-hydroxysteroid dehydrogenase type 1(Human)
Chuq-Pavillon Chul and Université

Curated by ChEMBL
LigandPNGBDBM50179194(5'-O-{10-[3',17'beta-dihydroxy-1',3',5'(10')-estra...)
Affinity DataIC50: 140nMAssay Description:Inhibition of 17beta-HSD1 expressed in HEK 293 cells assessed as conversion of [14C]estrone to [14C]estradiolMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed