BDBM264486 3-cyanooestra-1,3,5(10),16-tetraen-17-yl trifluoromethanesulphonate::US9714266, 15

SMILES [H][C@@]12CC=C(OS(=O)(=O)C(F)(F)F)[C@@]1(C)CC[C@]1([H])c3ccc(cc3CC[C@@]21[H])C#N

InChI Key InChIKey=AVOHVRXCSSNMFN-VXNCWWDNSA-N

Data  1 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 1 hit for monomerid = 264486   

TargetAldo-keto reductase family 1 member C3(Homo sapiens (Human))
Bayer Pharma Aktiengesellschaft

US Patent
LigandPNGBDBM264486(3-cyanooestra-1,3,5(10),16-tetraen-17-yl trifluoro...)
Affinity DataIC50:  25nMpH: 7.0Assay Description:For the assay, 50 nl of a 100-fold concentrated solution of the test substance in DMSO were pipetted into a black low-volume 384-well microtitre plat...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent