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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stromelysin-3' and Ligand = 'BDBM50480360'   
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-3


(Mus musculus)
BDBM50480360
PNG
(CHEMBL466908)
Show SMILES COc1c(O)c(C(=O)C2=CN3C=CC=CC3N=C2)c(OC)c2ccoc12 |c:11,13,17,t:8|
Show InChI InChI=1S/C19H16N2O5/c1-24-17-12-6-8-26-18(12)19(25-2)16(23)14(17)15(22)11-9-20-13-5-3-4-7-21(13)10-11/h3-10,13,23H,1-2H3
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.0320n/an/an/an/an/an/a



National Research Centre

Curated by ChEMBL


Assay Description
Cytotoxicity against human NB-1 cells by MTT assay


Bioorg Med Chem Lett 19: 2420-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.069
BindingDB Entry DOI: 10.7270/Q2W098R8
More data for this
Ligand-Target Pair