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SMILES: COc1ccc(OCC(=O)NNC(=S)NCCCCC2CCCCC2)cc1

InChI Key: InChIKey=GKZNTTMHVCTPDM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50441581   
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
A disintegrin and metalloproteinase with thrombospondin motifs 5


(Homo sapiens (Human))		BDBM50441581
PNG
(CHEMBL2437161)
Show SMILES COc1ccc(OCC(=O)NNC(=S)NCCCCC2CCCCC2)cc1
Show InChI InChI=1S/C20H31N3O3S/c1-25-17-10-12-18(13-11-17)26-15-19(24)22-23-20(27)21-14-6-5-9-16-7-3-2-4-8-16/h10-13,16H,2-9,14-15H2,1H3,(H,22,24)(H2,21,23,27)
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n/an/a>1.00E+5n/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