BDBM50249916 (8S,9S,12S,13R,14S,16R)-8,13,14-trimethoxy-4,10,12,16-tetramethyl-3,20,22-trioxo-19-(2-(pyrrolidin-1-yl)ethylamino)-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl carbamate::CHEMBL506191

SMILES CO[C@H]1C[C@H](C)Cc2c(O)c(NC(=O)C(C)=CC=C[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1OC)cc(O)c2N=CCN1CCCC1

InChI Key InChIKey=WSTDYIFJLOXLEY-RXPOPCBCSA-N

Data  1 Kd

  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 = 50249916   

TargetHeat shock protein HSP 90-beta(Homo sapiens (Human))
Kosan Biosciences

Curated by ChEMBL
LigandPNGBDBM50249916((8S,9S,12S,13R,14S,16R)-8,13,14-trimethoxy-4,10,12...)
Affinity DataKd:  1.00E+3nMAssay Description:Binding affinity to human recombinant HSP90More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed