Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 547.9 BDBM124287

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
Prostaglandin E synthase (Homo sapiens (Human))	BDBM124287 (US8759537, 24) Show SMILES CC(C)(C)C(=O)NCc1ccc(F)c(Nc2nc3cc(F)c(cc3[nH]2)C(=O)Nc2ccc(F)c(Cl)c2)c1F Show InChI InChI=1S/C26H22ClF4N5O2/c1-26(2,3)24(38)32-11-12-4-6-17(29)22(21(12)31)36-25-34-19-9-14(18(30)10-20(19)35-25)23(37)33-13-5-7-16(28)15(27)8-13/h4-10H,11H2,1-3H3,(H,32,38)(H,33,37)(H2,34,35,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	7.4	25
Boehringer Ingelheim International GmbH US Patent					Assay Description The aim of this assay is to determine the affinity of a test compound for the mPGES-1 enzyme. 47 ul of recombinant human mPGES-1 (0.5 ug protein/wel...				US Patent US8759537 (2014) BindingDB Entry DOI: 10.7270/Q2959G7G
					More data for this Ligand-Target Pair