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SMILES: OC(=O)c1nc(C2CCCCC2)n(c1-c1ccc(F)c(Cl)c1)-c1cccc(Cl)c1F

InChI Key: InChIKey=OKZRWZNDCUYSPD-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50012590   
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
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))
BDBM50012590
PNG
(CHEMBL3260814)
Show SMILES OC(=O)c1nc(C2CCCCC2)n(c1-c1ccc(F)c(Cl)c1)-c1cccc(Cl)c1F |(23.17,-13.47,;22.5,-14.86,;20.96,-14.97,;23.36,-16.14,;24.91,-16.19,;25.33,-17.67,;26.77,-18.2,;27.04,-19.72,;28.48,-20.25,;29.67,-19.26,;29.39,-17.74,;27.95,-17.21,;24.05,-18.53,;22.84,-17.58,;21.3,-17.58,;20.53,-18.9,;18.99,-18.9,;18.22,-17.56,;16.68,-17.55,;19,-16.23,;18.24,-14.89,;20.54,-16.24,;24,-20.07,;22.63,-20.79,;22.58,-22.32,;23.88,-23.14,;25.25,-22.41,;26.56,-23.23,;25.3,-20.88,;26.66,-20.15,)|
Show InChI InChI=1S/C22H18Cl2F2N2O2/c23-14-7-4-8-17(18(14)26)28-20(13-9-10-16(25)15(24)11-13)19(22(29)30)27-21(28)12-5-2-1-3-6-12/h4,7-12H,1-3,5-6H2,(H,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Inhibition of MDM2 (unknown origin) (2 to 188) assessed as inhibition of p53-MDM2 interaction by TR-FRET assay


Bioorg Med Chem Lett 24: 2110-4 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.039
BindingDB Entry DOI: 10.7270/Q2RJ4M1C
More data for this
Ligand-Target Pair