BDBM50173910 1H-Pyrrole-2-carboxylic acid (E)-(8R,10R,15S,20S)-19-amino-13-(S)-hydroxy-8,14-dimethoxy-4,12,16-trimethyl-10-(S)-methyl-3,20,22-trioxo-2-aza-bicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl ester::CHEMBL372694

SMILES CO[C@H]1CC(C)=Cc2c(N)c(O)cc(NC(=O)C(C)=CC=C[C@H](OC)[C@@H](OC(=O)c3ccc[nH]3)\C(C)=C\[C@H](C)[C@H]1O)c2O

InChI Key InChIKey=PAFRXDKFWWNTGF-UHFFFAOYSA-N

Data  1 Kd

  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 1 hit for monomerid = 50173910   

TargetHeat shock protein HSP 90-alpha(Human)
Kosan Biosciences

Curated by ChEMBL
LigandPNGBDBM50173910(1H-Pyrrole-2-carboxylic acid (E)-(8R,10R,15S,20S)-...)
Affinity DataKd: >1.00E+5nMAssay Description:Binding affinity for human heat shock protein 90 in scintillation proximity assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed