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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 = 'BDBM50311089'   
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))
BDBM50311089
PNG
(CHEMBL1078624 | rac-1-(5-(4-chloro-1H-pyrazol-1-yl...)
Show SMILES CC(C)[C@H]1C[C@@]1(NS(=O)(=O)c1ccc(s1)-n1cc(Cl)cn1)C(O)=O |r|
Show InChI InChI=1S/C14H16ClN3O4S2/c1-8(2)10-5-14(10,13(19)20)17-24(21,22)12-4-3-11(23-12)18-7-9(15)6-16-18/h3-4,6-8,10,17H,5H2,1-2H3,(H,19,20)/t10-,14+/m1/s1
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Similars

Article
PubMed
n/an/a 770n/an/an/an/an/an/a



Central Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of ADAMTS5


Bioorg Med Chem Lett 19: 6213-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.093
BindingDB Entry DOI: 10.7270/Q2ZS2WMT
More data for this
Ligand-Target Pair