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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50063913'   
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
Stromelysin-1


(Homo sapiens (Human))
BDBM50063913
PNG
((R)-N*1*-((S)-Cyclohexyl-methylcarbamoyl-methyl)-N...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)CC(=O)NO)C1CCCCC1
Show InChI InChI=1S/C17H31N3O4/c1-11(2)9-13(10-14(21)20-24)16(22)19-15(17(23)18-3)12-7-5-4-6-8-12/h11-13,15,24H,4-10H2,1-3H3,(H,18,23)(H,19,22)(H,20,21)/t13-,15+/m1/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a 2.30n/an/an/an/an/an/a



Kanebo Ltd.

Curated by ChEMBL


Assay Description
Activity against Matrix metalloproteinase-3 (MMP-3).


J Med Chem 41: 1209-17 (1998)


Article DOI: 10.1021/jm970404a
BindingDB Entry DOI: 10.7270/Q2SQ8ZHB
More data for this
Ligand-Target Pair