BDBM50616239 CHEMBL5431579

SMILES COc1c(C)cnc(Cn2cc(C#CCCn3cc(CNC(=O)CN4CCN(CC4)c4ccc(Nc5ncc6c(C)c(C(C)=O)c(=O)n(C7CCCC7)c6n5)nc4)nn3)c3c(Cl)nc(N)nc23)c1C

InChI Key InChIKey=VSAXVERDPZMCPX-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 = 50616239   

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

Curated by ChEMBL
LigandPNGBDBM50616239(CHEMBL5431579)
Affinity DataKd:  3.60nMAssay 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