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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phospholipase A2' and Ligand = 'BDBM111814'   
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))
BDBM111814
PNG
(2,5-Bis[4-(methylaminoethanol)benzylidene] cyclope...)
Show SMILES CNC(CO)c1ccc(\C=C2/CC\C(=C/c3ccc(cc3)C(CO)NC)C2=O)cc1
Show InChI InChI=1S/C25H30N2O3/c1-26-23(15-28)19-7-3-17(4-8-19)13-21-11-12-22(25(21)30)14-18-5-9-20(10-6-18)24(16-29)27-2/h3-10,13-14,23-24,26-29H,11-12,15-16H2,1-2H3/b21-13+,22-14+
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MMDB

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PC cid
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Similars

Article
PubMed
n/an/a 1.91E+4n/an/an/an/a8.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
Substrate 1,2-bis(heptanoylthio)-glycerophosphocholine and human recombinant PLA2-V were resuspended in assay buffer, and DTNB was dissolved in an aq...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair