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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'LIP1, secretory lipase (Family 3)' and Ligand = 'BDBM50112886'   
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
LIP1, secretory lipase (Family 3)


(Malassezia globosa (strain ATCC MYA-4612 / CBS 796...)
BDBM50112886
PNG
(CHEMBL3609533)
Show SMILES O=C1N(CCSC(=S)N2CCCC2)Cc2ccccc12
Show InChI InChI=1S/C15H18N2OS2/c18-14-13-6-2-1-5-12(13)11-17(14)9-10-20-15(19)16-7-3-4-8-16/h1-2,5-6H,3-4,7-11H2
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CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 2.29E+4n/an/an/an/an/an/a



South China University of Technology

Curated by ChEMBL


Assay Description
Inhibition of Malassezia globosa CBS 7966 LIP1 using pNPC substrate


Bioorg Med Chem Lett 25: 3464-7 (2015)


Article DOI: 10.1016/j.bmcl.2015.07.005
BindingDB Entry DOI: 10.7270/Q28P6294
More data for this
Ligand-Target Pair