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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phospholipase D1' and Ligand = 'BDBM50258261'   
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 D1


(Homo sapiens (Human))
BDBM50258261
PNG
(CHEMBL494587 | racemic trans-N-((S)-1-(4-(4-fluoro...)
Show SMILES C[C@@H](CN1CCC(CC1)n1c2cccc(F)c2[nH]c1=O)NC(=O)[C@@H]1C[C@H]1c1ccccc1 |r|
Show InChI InChI=1S/C25H29FN4O2/c1-16(27-24(31)20-14-19(20)17-6-3-2-4-7-17)15-29-12-10-18(11-13-29)30-22-9-5-8-21(26)23(22)28-25(30)32/h2-9,16,18-20H,10-15H2,1H3,(H,27,31)(H,28,32)/t16-,19-,20+/m0/s1
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Similars

Article
PubMed
n/an/a 100n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Inhibition of human PLD1 in Calu1 cells


Bioorg Med Chem Lett 19: 1916-20 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.057
BindingDB Entry DOI: 10.7270/Q2VM4C5W
More data for this
Ligand-Target Pair