Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 461.4 BDBM412349

Wt: 461.4 BDBM412354

Wt: 461.4 US11912681, Compound B

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

Found 3 hits 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
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM412349 (US10399958, Compound 2n) Show SMILES CC(CCCOc1ccccc1Cn1c(C)cnc1-c1ccc(nc1)C(F)(F)F)CC(O)=O Show InChI InChI=1S/C24H26F3N3O3/c1-16(12-22(31)32)6-5-11-33-20-8-4-3-7-19(20)15-30-17(2)13-29-23(30)18-9-10-21(28-14-18)24(25,26)27/h3-4,7-10,13-14,16H,5-6,11-12,15H2,1-2H3,(H,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	n/a	n/a	4.40	n/a	n/a	n/a	n/a
Mitobridge, Inc. US Patent					Assay Description Medium including test compound was aspirated and washed with PBS. 50 μl PBS including 1 mM Mg++ and Ca++ were then added to each well. The lucif...				US Patent US10399958 (2019) BindingDB Entry DOI: 10.7270/Q26Q20MJ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta [128-441] (Homo sapiens (Human))	US11912681, Compound B ((R)-3-methyl-6-(2-((5-methyl-2-(6-(trifluoromethyl...) Show SMILES C[C@H](CCCOc1ccccc1Cn1c(C)cnc1-c1ccc(nc1)C(F)(F)F)CC(O)=O |r| Show InChI	GoogleScholar AffyNet	UniChem		n/a	n/a	n/a	n/a	4.40	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM412354 ((S)-3-methyl-6-(2-((5-methyl-2-(6-(trifluoromethyl...) Show SMILES C[C@@H](CCCOc1ccccc1Cn1c(C)cnc1-c1ccc(nc1)C(F)(F)F)CC(O)=O |r| Show InChI InChI=1S/C24H26F3N3O3/c1-16(12-22(31)32)6-5-11-33-20-8-4-3-7-19(20)15-30-17(2)13-29-23(30)18-9-10-21(28-14-18)24(25,26)27/h3-4,7-10,13-14,16H,5-6,11-12,15H2,1-2H3,(H,31,32)/t16-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	UniChem	US Patent	n/a	n/a	n/a	n/a	227	n/a	n/a	n/a	n/a
Mitobridge, Inc. US Patent					Assay Description Medium including test compound was aspirated and washed with PBS. 50 μl PBS including 1 mM Mg++ and Ca++ were then added to each well. The lucif...				US Patent US10399958 (2019) BindingDB Entry DOI: 10.7270/Q26Q20MJ
					More data for this Ligand-Target Pair