Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 506.5 BDBM451388

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

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Diacylglycerol O-acyltransferase 1 (Homo sapiens (Human))	BDBM451388 (US10709718, Compound 11) Show SMILES CC1(C)Oc2ncnc(N)c2N=C1c1ccc(cc1)C1CC[C@@H](CC1)OP(O)(=O)Cc1ccccc1 |r,wD:22.28,c:12,(-2.98,-6.62,;-4.31,-5.85,;-2.98,-5.08,;-5.64,-6.62,;-6.98,-5.85,;-8.31,-6.62,;-9.65,-5.85,;-9.65,-4.31,;-8.31,-3.54,;-8.31,-2,;-6.98,-4.31,;-5.64,-3.54,;-4.31,-4.31,;-2.98,-3.54,;-1.64,-4.31,;-.31,-3.54,;-.31,-2,;-1.64,-1.23,;-2.98,-2,;1.02,-1.23,;1.02,.31,;2.36,1.08,;3.69,.31,;3.69,-1.23,;2.36,-2,;5.03,1.08,;5.03,2.62,;5.03,4.16,;3.49,2.62,;6.57,2.62,;7.34,3.95,;8.88,3.95,;9.65,5.29,;8.88,6.62,;7.34,6.62,;6.57,5.29,)| Show InChI InChI=1S/C27H31N4O4P/c1-27(2)24(31-23-25(28)29-17-30-26(23)34-27)21-10-8-19(9-11-21)20-12-14-22(15-13-20)35-36(32,33)16-18-6-4-3-5-7-18/h3-11,17,20,22H,12-16H2,1-2H3,(H,32,33)(H2,28,29,30)/t20?,22-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
Metabasis Therapeutics, Inc. US Patent					Assay Description The inhibition of DGAT-1 activity can be assessed in intestinal microsome preparations by monitoring the incorporation of radiolabeled fatty acyl-CoA...				US Patent US10709718 (2020) BindingDB Entry DOI: 10.7270/Q2XG9V68
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