BDBM50087453 CHEMBL3426740

SMILES Cc1cc(c(c(c1)C)Sc2nc3c(ncnc3n2CCCC#C)N)C

InChI Key InChIKey=FFJTXDGAXOSYBK-UHFFFAOYSA-N

Data  4 IC50

PDB links: 2 PDB IDs match this monomer.

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50087453   

TargetEndoplasmin(Human)
Sloan-Kettering Institute For Cancer Research

Curated by ChEMBL
LigandPNGBDBM50087453(CHEMBL3426740)
Affinity DataIC50: 2.10E+3nMAssay Description:Displacement of Cy3B-GM from recombinant Grp94 (unknown origin) after 24 hrs by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2016
Entry Details Article
PubMed
TargetHeat shock protein HSP 90-alpha(Human)
Sloan-Kettering Institute For Cancer Research

Curated by ChEMBL
LigandPNGBDBM50087453(CHEMBL3426740)
Affinity DataIC50: 5.00E+5nMAssay Description:Displacement of Cy3B-GM from recombinant Hsp90alpha (unknown origin) after 24 hrs by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2016
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetHeat shock protein 75 kDa, mitochondrial(Human)
Sloan-Kettering Institute For Cancer Research

Curated by ChEMBL
LigandPNGBDBM50087453(CHEMBL3426740)
Affinity DataIC50: 6.55E+4nMAssay Description:Displacement of PU-FITC3 from recombinant TRAP-1 (unknown origin) after 24 hrs by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2016
Entry Details Article
PubMed
TargetHeat shock protein HSP 90-beta(Human)
Sloan-Kettering Institute For Cancer Research

Curated by ChEMBL
LigandPNGBDBM50087453(CHEMBL3426740)
Affinity DataIC50: 5.00E+5nMAssay Description:Displacement of Cy3B-GM from recombinant Hsp90beta (unknown origin) after 24 hrs by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2016
Entry Details Article
PubMedPDB3D3D Structure (crystal)