BDBM50237104 2-((8R,9S,13S,14S,16R)-2-ethyl-3-hydroxy-13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-16-yl)-N-(pyridin-3-ylmethyl)acetamide::CHEMBL407968

SMILES CCc1cc2[C@H]3CC[C@@]4(C)[C@@H](C[C@H](CC(=O)NCc5cccnc5)C4=O)[C@@H]3CCc2cc1O

InChI Key InChIKey=NUVJNTKMOQNMCM-NZRQHWDYSA-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 = 50237104   

Target17-beta-hydroxysteroid dehydrogenase type 1(Homo sapiens (Human))
University Of Bath

Curated by ChEMBL
LigandPNGBDBM50237104(2-((8R,9S,13S,14S,16R)-2-ethyl-3-hydroxy-13-methyl...)
Affinity DataIC50:  27nMAssay Description:Inhibitory activity against 17 beta hydroxysteroid dehydrogenase type 1 in T47D cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target17-beta-hydroxysteroid dehydrogenase type 1(Homo sapiens (Human))
University Of Bath

Curated by ChEMBL
LigandPNGBDBM50237104(2-((8R,9S,13S,14S,16R)-2-ethyl-3-hydroxy-13-methyl...)
Affinity DataIC50:  27nMAssay Description:Inhibition of 17beta-HSD1 expressed in intact human T47D cells after 30 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target17-beta-hydroxysteroid dehydrogenase type 1(Homo sapiens (Human))
University Of Bath

Curated by ChEMBL
LigandPNGBDBM50237104(2-((8R,9S,13S,14S,16R)-2-ethyl-3-hydroxy-13-methyl...)
Affinity DataIC50:  27nMAssay Description:Inhibition of human recombinant 17beta-HSD1 expressed in HEK293 cell lysate assessed as conversion of radiolabeled estrone to estradiolMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed