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SMILES: COc1ccc(CC(OC(=O)\C=C\c2ccc(cc2)[N+]([O-])=O)C(=O)OCC=C)cc1OC

InChI Key: InChIKey=IZWFVCOUNMHCHX-XYOKQWHBSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50429235   
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
Interstitial collagenase


(Homo sapiens (Human))		BDBM50429235
PNG
(CHEMBL2333285)
Show SMILES COc1ccc(CC(OC(=O)\C=C\c2ccc(cc2)[N+]([O-])=O)C(=O)OCC=C)cc1OC
Show InChI InChI=1S/C23H23NO8/c1-4-13-31-23(26)21(15-17-7-11-19(29-2)20(14-17)30-3)32-22(25)12-8-16-5-9-18(10-6-16)24(27)28/h4-12,14,21H,1,13,15H2,2-3H3/b12-8+
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