BDBM50105868 CHEMBL3597766

SMILES: CCOC(=O)CCCCCNC(=O)n1ccc(n1)C(=O)Nc1ccc(F)cc1Cl

InChI Key: InChIKey=PUYPDYJSESZMDB-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 = 50105868   

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 15-lipoxygenase (Homo sapiens (Human))	BDBM50105868 (CHEMBL3597766) Show SMILES CCOC(=O)CCCCCNC(=O)n1ccc(n1)C(=O)Nc1ccc(F)cc1Cl Show InChI InChI=1S/C19H22ClFN4O4/c1-2-29-17(26)6-4-3-5-10-22-19(28)25-11-9-16(24-25)18(27)23-15-8-7-13(21)12-14(15)20/h7-9,11-12H,2-6,10H2,1H3,(H,22,28)(H,23,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	141	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Inhibition of human 15-LOX-1 using arachidonic acid as substrate by cell based assay				Bioorg Med Chem Lett 25: 3017-23 (2015) BindingDB Entry DOI: 10.7270/Q2F191G3
					More data for this Ligand-Target Pair
Arachidonate 15-lipoxygenase (Homo sapiens (Human))	BDBM50105868 (CHEMBL3597766) Show SMILES CCOC(=O)CCCCCNC(=O)n1ccc(n1)C(=O)Nc1ccc(F)cc1Cl Show InChI InChI=1S/C19H22ClFN4O4/c1-2-29-17(26)6-4-3-5-10-22-19(28)25-11-9-16(24-25)18(27)23-15-8-7-13(21)12-14(15)20/h7-9,11-12H,2-6,10H2,1H3,(H,22,28)(H,23,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Inhibition of human 15-LOX-1 using arachidonic acid as substrate				Bioorg Med Chem Lett 25: 3017-23 (2015) BindingDB Entry DOI: 10.7270/Q2F191G3
					More data for this Ligand-Target Pair