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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50063916'   
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))
BDBM50063916
PNG
((R)-N*4*-Hydroxy-N*1*-((S)-methylcarbamoyl-phenyl-...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CCCc1ccccc1)CC(=O)NO)c1ccccc1
Show InChI InChI=1S/C22H27N3O4/c1-23-22(28)20(17-12-6-3-7-13-17)24-21(27)18(15-19(26)25-29)14-8-11-16-9-4-2-5-10-16/h2-7,9-10,12-13,18,20,29H,8,11,14-15H2,1H3,(H,23,28)(H,24,27)(H,25,26)/t18-,20+/m1/s1
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MMDB

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Article
PubMed
n/an/a 9.60n/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