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BDBM50361676 CHEMBL1940919

SMILES: CCNC(=O)c1noc(c1NC(=O)C(C)(C)C)-c1cc(Cl)c(O)cc1O

InChI Key: InChIKey=NRDHRUUAIBGJLZ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50361676   
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
HSP90 and hnRNPA2/B1


(Homo sapiens (Human))
BDBM50361676
PNG
(CHEMBL1940919)
Show SMILES CCNC(=O)c1noc(c1NC(=O)C(C)(C)C)-c1cc(Cl)c(O)cc1O
Show InChI InChI=1S/C17H20ClN3O5/c1-5-19-15(24)13-12(20-16(25)17(2,3)4)14(26-21-13)8-6-9(18)11(23)7-10(8)22/h6-7,22-23H,5H2,1-4H3,(H,19,24)(H,20,25)
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 85n/an/an/an/an/an/a



Universit£ degli Studi di Ferrara

Curated by ChEMBL


Assay Description
Binding affinity to Hsp90 after 4 hrs by fluorescence polarization assay


J Med Chem 54: 8592-604 (2011)


Article DOI: 10.1021/jm201155e
BindingDB Entry DOI: 10.7270/Q2QF8T9M
More data for this
Ligand-Target Pair