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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Matrix metalloproteinase-14' and Ligand = 'BDBM50111992'   
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
Matrix metalloproteinase-14


(Homo sapiens (Human))
BDBM50111992
PNG
(CHEMBL173533 | N-{(S)-1-[(R)-2-(4-Benzyloxy-phenyl...)
Show SMILES CN(C)C(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)C(=O)NO
Show InChI InChI=1S/C29H32N4O6/c1-33(2)29(37)25(18-21-13-15-23(16-14-21)39-19-22-11-7-4-8-12-22)31-26(34)24(30-27(35)28(36)32-38)17-20-9-5-3-6-10-20/h3-16,24-25,38H,17-19H2,1-2H3,(H,30,35)(H,31,34)(H,32,36)/t24-,25+/m0/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

PubMed
1.40E+3n/an/an/an/an/an/an/an/a



University of Bielefeld

Curated by ChEMBL


Assay Description
Inhibition of membrane type MT1-MMP (Matrix metalloproteinase-14)catalytic domain


Bioorg Med Chem Lett 12: 933-6 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C35
More data for this
Ligand-Target Pair