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SMILES: [O-][N+](=O)c1ccc(Oc2ccc(cc2)C(=O)NCc2ccncc2)cc1

InChI Key: InChIKey=VMLFXCWYXVKOOC-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50418809   
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
Collagenase 3


(Homo sapiens (Human))		BDBM50418809
PNG
(CHEMBL1796291)
Show SMILES [O-][N+](=O)c1ccc(Oc2ccc(cc2)C(=O)NCc2ccncc2)cc1
Show InChI InChI=1S/C19H15N3O4/c23-19(21-13-14-9-11-20-12-10-14)15-1-5-17(6-2-15)26-18-7-3-16(4-8-18)22(24)25/h1-12H,13H2,(H,21,23)
PDB
MMDB

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Article
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MMP13 using Mca-Pro-cyclohexyl-Ala-Gly-Nva-His-Ala-Dap(Dnp)-NH2 substrate

Bioorg Med Chem Lett 21: 4215-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.075
BindingDB Entry DOI: 10.7270/Q2WH2R89
More data for this
Ligand-Target Pair