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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Interstitial collagenase' and Ligand = 'BDBM50095219'   
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))
BDBM50095219
PNG
(2-(4-Benzyl-piperidine-1-sulfonyl)-N-hydroxy-benza...)
Show SMILES ONC(=O)c1ccccc1S(=O)(=O)N1CCC(Cc2ccccc2)CC1
Show InChI InChI=1S/C19H22N2O4S/c22-19(20-23)17-8-4-5-9-18(17)26(24,25)21-12-10-16(11-13-21)14-15-6-2-1-3-7-15/h1-9,16,23H,10-14H2,(H,20,22)
PDB
MMDB

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PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Pharmacia

Curated by ChEMBL


Assay Description
50 percent inhibition of human Matrix metalloprotease-1 by the cleavage of fluorogenic peptide MCA-Pro-Leu-Gly-Leu-Dpa-ala-Arg-NH2


Bioorg Med Chem Lett 10: 2815-7 (2000)


BindingDB Entry DOI: 10.7270/Q2ZK5H6Z
More data for this
Ligand-Target Pair