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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50429245   
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))		BDBM50429245
PNG
(CHEMBL2333275)
Show SMILES COc1ccc(CC(OC(=O)\C=C\c2ccc3CCOc3c2)C(O)=O)cc1OC
Show InChI InChI=1S/C22H22O7/c1-26-17-7-4-15(12-19(17)27-2)13-20(22(24)25)29-21(23)8-5-14-3-6-16-9-10-28-18(16)11-14/h3-8,11-12,20H,9-10,13H2,1-2H3,(H,24,25)/b8-5+
PDB
MMDB

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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Second Military Medical University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MMP1 catalytic domain using Dnp-Pro-beta-cyclohexyl-Ala-Gly-Cys(Me)-His-Lys-(Nma)-NH2 as substrate preincubated with ...

Eur J Med Chem 62: 148-57 (2013)


Article DOI: 10.1016/j.ejmech.2012.09.047
BindingDB Entry DOI: 10.7270/Q2VQ341V
More data for this
Ligand-Target Pair