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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50122489   
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 4


(Homo sapiens (Human))		BDBM50122489
PNG
(CHEMBL3622478)
Show SMILES CCN(C(=O)c1ccc(CNc2nc(NC(C)C)nc(n2)N2CCc3cc(OC)c(OC)cc3C2)cc1)c1cccc(C)c1
Show InChI InChI=1S/C34H41N7O3/c1-7-41(28-10-8-9-23(4)17-28)31(42)25-13-11-24(12-14-25)20-35-32-37-33(36-22(2)3)39-34(38-32)40-16-15-26-18-29(43-5)30(44-6)19-27(26)21-40/h8-14,17-19,22H,7,15-16,20-21H2,1-6H3,(H2,35,36,37,38,39)
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of recombinant human ADAMTS4 (213 to 575 amino acid residues) using WAAG-3R as substrate preincubated for 15 mins followed by substrate ad...

ACS Med Chem Lett 6: 888-93 (2015)


Article DOI: 10.1021/acsmedchemlett.5b00138
BindingDB Entry DOI: 10.7270/Q2416ZWQ
More data for this
Ligand-Target Pair