BDBM50443843 CHEMBL3094429

SMILES: CCCCCCC(Sc1nc(Cl)cc(Nc2cccc(c2)-c2ccccc2)n1)C(O)=O

InChI Key: InChIKey=GCNKWPJVLXPSLY-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50443843   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50443843 (CHEMBL3094429) Show SMILES CCCCCCC(Sc1nc(Cl)cc(Nc2cccc(c2)-c2ccccc2)n1)C(O)=O Show InChI InChI=1S/C24H26ClN3O2S/c1-2-3-4-8-14-20(23(29)30)31-24-27-21(25)16-22(28-24)26-19-13-9-12-18(15-19)17-10-6-5-7-11-17/h5-7,9-13,15-16,20H,2-4,8,14H2,1H3,(H,29,30)(H,26,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Goethe-University Frankfurt Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes				J Med Chem 56: 9031-44 (2013) Article DOI: 10.1021/jm401557w BindingDB Entry DOI: 10.7270/Q24B32R4
					More data for this Ligand-Target Pair
Prostaglandin E synthase (Homo sapiens (Human))	BDBM50443843 (CHEMBL3094429) Show SMILES CCCCCCC(Sc1nc(Cl)cc(Nc2cccc(c2)-c2ccccc2)n1)C(O)=O Show InChI InChI=1S/C24H26ClN3O2S/c1-2-3-4-8-14-20(23(29)30)31-24-27-21(25)16-22(28-24)26-19-13-9-12-18(15-19)17-10-6-5-7-11-17/h5-7,9-13,15-16,20H,2-4,8,14H2,1H3,(H,29,30)(H,26,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Goethe-University Frankfurt Curated by ChEMBL					Assay Description Inhibition of mPGES-1 (unknown origin)				J Med Chem 56: 9031-44 (2013) Article DOI: 10.1021/jm401557w BindingDB Entry DOI: 10.7270/Q24B32R4
					More data for this Ligand-Target Pair