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BDBM201444 US9187424, 210

InChI string: InChI=1/C27H25F6N5O2/c28-26(29,30)12-3-13-40-20-10-8-19(9-11-20)25(27(31,32)33)15-21(22(24(39)34-25)23-35-37-38-36-23)18-7-6-16-4-1-2-5-17(16)14-18/h6-11,14H,1-5,12-13,15H2,(H,34,39)(H,35,36,37,38)

SMILES: FC(F)(F)CCCOc1ccc(cc1)C1(CC(=C(c2nn[nH]n2)C(=O)N1)c1ccc2CCCCc2c1)C(F)(F)F

InChI Key: InChIKey=WTTWTRGCHIMLAG-UHFFFAOYNA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 201444   
Target
(Institution)
LigandTarget
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
Monoacylglycerol acyltransferase type 2 (h-MGAT2)


(Homo sapiens (Human))
BDBM201444
PNG
(US9187424, 210)
Show SMILES FC(F)(F)CCCOc1ccc(cc1)C1(CC(=C(c2nn[nH]n2)C(=O)N1)c1ccc2CCCCc2c1)C(F)(F)F
Show InChI InChI=1/C27H25F6N5O2/c28-26(29,30)12-3-13-40-20-10-8-19(9-11-20)25(27(31,32)33)15-21(22(24(39)34-25)23-35-37-38-36-23)18-7-6-16-4-1-2-5-17(16)14-18/h6-11,14H,1-5,12-13,15H2,(H,34,39)(H,35,36,37,38)
UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
AffyNet 
US Patent
n/an/a 2n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in CORNING Falcon 96-well Polypropylene plates, in a total volume of 60 uL of 50 mM Potassium Phosphate buff...


US Patent US9187424 (2015)

More data for this
Ligand-Target Pair