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BDBM50013900 CHEMBL3260487

SMILES: Oc1cc(O)c(cc1C(=O)N1Cc2ccccc2C1)-n1ccc2c(cccc12)[N+]([O-])=O

InChI Key: InChIKey=QHNRMNCQNXEHEB-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50013900   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Heat shock protein HSP 90-alpha


(Homo sapiens (Human))
BDBM50013900
PNG
(CHEMBL3260487)
Show SMILES Oc1cc(O)c(cc1C(=O)N1Cc2ccccc2C1)-n1ccc2c(cccc12)[N+]([O-])=O
Show InChI InChI=1S/C23H17N3O5/c27-21-11-22(28)20(25-9-8-16-18(25)6-3-7-19(16)26(30)31)10-17(21)23(29)24-12-14-4-1-2-5-15(14)13-24/h1-11,27-28H,12-13H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 39n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of GM-BODIPY from human full length HSP90 alpha expressed in baculovirus-infected Sf9 cells after 16 hrs by fluorescence polarization as...


Bioorg Med Chem Lett 24: 2525-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.100
BindingDB Entry DOI: 10.7270/Q2QF8VDC
More data for this
Ligand-Target Pair