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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Luciferase' and Ligand = 'BDBM50352641'   
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
Luciferase


(Luciola lateralis)
BDBM50352641
PNG
(CHEMBL1733803)
Show SMILES OC(=O)C1CCN(CC1)c1ncc(s1)-c1ccc2OCCCOc2c1
Show InChI InChI=1S/C18H20N2O4S/c21-17(22)12-4-6-20(7-5-12)18-19-11-16(25-18)13-2-3-14-15(10-13)24-9-1-8-23-14/h2-3,10-12H,1,4-9H2,(H,21,22)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



National Human Genome Research Institute

Curated by ChEMBL


Assay Description
Inhibition of fire fly luciferase


J Med Chem 54: 6215-33 (2011)


Article DOI: 10.1021/jm200497t
BindingDB Entry DOI: 10.7270/Q22F7NVF
More data for this
Ligand-Target Pair