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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 560.6
BDBM274980

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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))
BDBM274980
PNG
(N2-(tert-butyl)-N8-(isoquinolin-1-ylmethyl)- 5-(3-...)
Show SMILES CC(C)(C)NC(=O)N1CCc2c(C1)c(ccc2-c1cccc(c1)C(F)(F)F)C(=O)NCc1nccc2ccccc12
Show InChI InChI=1S/C32H31F3N4O2/c1-31(2,3)38-30(41)39-16-14-25-23(21-8-6-9-22(17-21)32(33,34)35)11-12-26(27(25)19-39)29(40)37-18-28-24-10-5-4-7-20(24)13-15-36-28/h4-13,15,17H,14,16,18-19H2,1-3H3,(H,37,40)(H,38,41)
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KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 197n/an/an/an/a7.025



Merck Sharp & Dohme Corp.

US Patent


Assay Description
DGAT2 activity was determined by measuring the amount of enzymatic product triolein (1,2,3-Tri(cis-9-octadecenoyl)glycerol) using the membrane prep m...


US Patent US9877957 (2018)


BindingDB Entry DOI: 10.7270/Q2Z60R2C
More data for this
Ligand-Target Pair