BDBM50616240 CHEMBL5402082

SMILES COc1c(C)cnc(Cn2cc(C#CCCn3cc(nn3)C(=O)NCCNC(=O)CN3CCN(CC3)c3ccc(Nc4ncc5c(C)c(C(C)=O)c(=O)n(C6CCCC6)c5n4)nc3)c3c(Cl)nc(N)nc23)c1C

InChI Key InChIKey=DMHVIBANXHYOML-UHFFFAOYSA-N

Data  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50616240   

TargetHeat shock protein HSP 90-alpha(Human)
Shandong University

Curated by ChEMBL
LigandPNGBDBM50616240(CHEMBL5402082)
Affinity DataKd:  6.80nMAssay Description:Binding affinity to CM5 sensor chip immobilized human HSP90alpha assessed as dissociation constant by SPR analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2024
Entry Details
PubMed