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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Interstitial collagenase' and Ligand = 'BDBM50273425'   
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
Interstitial collagenase


(Homo sapiens (Human))
BDBM50273425
PNG
(CHEMBL456774 | N-(4-Biphenylsulfonyl)-N-hydroxycar...)
Show SMILES CC(C)[C@@H](N(CC(O)=O)S(=O)(=O)c1ccc(cc1)-c1ccccc1)C(=O)NO |r|
Show InChI InChI=1S/C19H22N2O6S/c1-13(2)18(19(24)20-25)21(12-17(22)23)28(26,27)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11,13,18,25H,12H2,1-2H3,(H,20,24)(H,22,23)/t18-/m1/s1
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Article
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Instituto Superior Técnico

Curated by ChEMBL


Assay Description
Inhibition of MMP1


J Med Chem 51: 7968-79 (2008)


Article DOI: 10.1021/jm800964f
BindingDB Entry DOI: 10.7270/Q2XK8FDN
More data for this
Ligand-Target Pair