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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Heat shock protein HSP 90-alpha' and Ligand = 'BDBM50270609'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM50270609
PNG
((3E)-3-[(phenylamino)methylidene]dihydrofuran-2(3H...)
Show SMILES O=C1OCCC1=CNc1ccccc1 |w:6.7|
Show InChI InChI=1S/C11H11NO2/c13-11-9(6-7-14-11)8-12-10-4-2-1-3-5-10/h1-5,8,12H,6-7H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 1.50E+5n/an/an/a7.525



Abbott Laboratories



Assay Description
HSP90 inhibitors identified using NMR fragment-based screening assay.


Chem Biol Drug Des 70: 1-12 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00535.x
BindingDB Entry DOI: 10.7270/Q25X27DH
More data for this
Ligand-Target Pair