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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50288697'   
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))
BDBM50288697
PNG
((2-Benzylcarbamoyl-ethyl)-[(S)-2-((S)-3-methyl-1-p...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)CP(O)(=O)CCC(=O)NCc1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C33H42N3O5P/c1-25(2)22-30(33(39)35-29-16-10-5-11-17-29)36-32(38)28(19-18-26-12-6-3-7-13-26)24-42(40,41)21-20-31(37)34-23-27-14-8-4-9-15-27/h3-17,25,28,30H,18-24H2,1-2H3,(H,34,37)(H,35,39)(H,36,38)(H,40,41)/t28-,30+/m1/s1
PDB
MMDB

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Similars

Article
540n/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