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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'A disintegrin and metalloproteinase with thrombospondin motifs 5' and Ligand = 'BDBM50441590'   
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
A disintegrin and metalloproteinase with thrombospondin motifs 5


(Homo sapiens (Human))
BDBM50441590
PNG
(CHEMBL2437164)
Show SMILES FC(F)(F)c1ccc(OCC(=O)NNC(=S)NCCCCC2CCCCC2)cc1
Show InChI InChI=1S/C20H28F3N3O2S/c21-20(22,23)16-9-11-17(12-10-16)28-14-18(27)25-26-19(29)24-13-5-4-8-15-6-2-1-3-7-15/h9-12,15H,1-8,13-14H2,(H,25,27)(H2,24,26,29)
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PC cid
PC sid
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Article
PubMed
n/an/a 540n/an/an/an/an/an/a



INSERM

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ADAMTS-5 using ARGSVILTV-KPIFEVSPSPL(biotinyl)K as substrate incubated 10 mins prior to substrate addition measured a...


Eur J Med Chem 69: 244-61 (2013)


Article DOI: 10.1016/j.ejmech.2013.08.027
BindingDB Entry DOI: 10.7270/Q2J967TM
More data for this
Ligand-Target Pair