BindingDB logo
myBDB logout

BDBM274988 N2-(tert-butyl)-N8-((3-cyanoisoxazol-4- yl)methyl)-5-(3-(trifluoromethyl)phenyl)- 3,4-dihydroisoquinoline-2,8(1H)- dicarboxamide::US9877957, Example 27

SMILES: CC(C)(C)NC(=O)N1CCc2c(C1)c(ccc2-c1cccc(c1)C(F)(F)F)C(=O)NCc1conc1C#N

InChI Key: InChIKey=XWTJNRKPPADHRE-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 274988   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Diacylglycerol O-acyltransferase 2


(Homo sapiens (Human))
BDBM274988
PNG
(N2-(tert-butyl)-N8-((3-cyanoisoxazol-4- yl)methyl)...)
Show SMILES CC(C)(C)NC(=O)N1CCc2c(C1)c(ccc2-c1cccc(c1)C(F)(F)F)C(=O)NCc1conc1C#N
Show InChI InChI=1S/C27H26F3N5O3/c1-26(2,3)33-25(37)35-10-9-20-19(16-5-4-6-18(11-16)27(28,29)30)7-8-21(22(20)14-35)24(36)32-13-17-15-38-34-23(17)12-31/h4-8,11,15H,9-10,13-14H2,1-3H3,(H,32,36)(H,33,37)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 314n/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