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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phospholipase A2' and Ligand = 'BDBM80894'   
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
Phospholipase A2


(Homo sapiens (Human))
BDBM80894
PNG
(2-[3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2...)
Show SMILES [O-][N+](=O)c1ccccc1\C=C\C=N\NC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H18ClN5O4S/c26-18-11-13-19(14-12-18)30-24(33)20-8-2-3-9-21(20)28-25(30)36-16-23(32)29-27-15-5-7-17-6-1-4-10-22(17)31(34)35/h1-15H,16H2,(H,29,32)/b7-5+,27-15+
PDB
MMDB

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PCBioAssay
n/an/a 1.18E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q26M35BC
More data for this
Ligand-Target Pair