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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 2' and Ligand = 'BDBM323655'   
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
Diacylglycerol O-acyltransferase 2


(Homo sapiens (Human))
BDBM323655
PNG
((R)-N-cyclobutyl-2-(3-(2- ethoxyphenoxy)piperidin-...)
Show SMILES CCOc1ccccc1O[C@@H]1CCCN(C1)c1ncc(cn1)C(=O)NC1CCC1
Show InChI InChI=1S/C22H28N4O3/c1-2-28-19-10-3-4-11-20(19)29-18-9-6-12-26(15-18)22-23-13-16(14-24-22)21(27)25-17-7-5-8-17/h3-4,10-11,13-14,17-18H,2,5-9,12,15H2,1H3,(H,25,27)/t18-/m1/s1
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KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 10.7n/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
For determination of IC50 values, the reactions were carried out in 384-well white Polyplates (Perkin Elmer) in a total volume of 20 μL. To 14 o...


US Patent US9789110 (2017)


BindingDB Entry DOI: 10.7270/Q20G3N81
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 2


(Homo sapiens (Human))
BDBM323655
PNG
((R)-N-cyclobutyl-2-(3-(2- ethoxyphenoxy)piperidin-...)
Show SMILES CCOc1ccccc1O[C@@H]1CCCN(C1)c1ncc(cn1)C(=O)NC1CCC1
Show InChI InChI=1S/C22H28N4O3/c1-2-28-19-10-3-4-11-20(19)29-18-9-6-12-26(15-18)22-23-13-16(14-24-22)21(27)25-17-7-5-8-17/h3-4,10-11,13-14,17-18H,2,5-9,12,15H2,1H3,(H,25,27)/t18-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 10.7n/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
For determination of IC50 values, the reactions were carried out in 384-well white Polyplates (Perkin Elmer) in a total volume of 20 μL. To 14 o...


US Patent US10188653 (2019)


BindingDB Entry DOI: 10.7270/Q28G8NS4
More data for this
Ligand-Target Pair