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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50288695'   
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))
BDBM50288695
PNG
((4-Benzyloxycarbonylamino-butyl)-[(S)-2-((S)-3-met...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)CP(O)(=O)CCCCNC(=O)OCc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C35H46N3O6P/c1-27(2)24-32(34(40)37-31-18-10-5-11-19-31)38-33(39)30(21-20-28-14-6-3-7-15-28)26-45(42,43)23-13-12-22-36-35(41)44-25-29-16-8-4-9-17-29/h3-11,14-19,27,30,32H,12-13,20-26H2,1-2H3,(H,36,41)(H,37,40)(H,38,39)(H,42,43)/t30-,32+/m1/s1
PDB
MMDB

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Similars

Article
63n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of stromelysin-1 (MMP-3).


Bioorg Med Chem Lett 6: 323-328 (1996)


Article DOI: 10.1016/0960-894X(96)00023-6
BindingDB Entry DOI: 10.7270/Q2X0671M
More data for this
Ligand-Target Pair