BDBM50040420 4-Methoxy-4-[3-(naphthalen-2-yloxymethyl)-phenyl]-tetrahydro-pyran::CHEMBL149839

SMILES: COC1(CCOCC1)c1cccc(COc2ccc3ccccc3c2)c1

InChI Key: InChIKey=ICZDCNYKCROKCL-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 = 50040420   

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))	BDBM50040420 (4-Methoxy-4-[3-(naphthalen-2-yloxymethyl)-phenyl]-...) Show SMILES COC1(CCOCC1)c1cccc(COc2ccc3ccccc3c2)c1 Show InChI InChI=1S/C23H24O3/c1-24-23(11-13-25-14-12-23)21-8-4-5-18(15-21)17-26-22-10-9-19-6-2-3-7-20(19)16-22/h2-10,15-16H,11-14,17H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research Curated by ChEMBL					Assay Description In vitro potency against human 5-Lipoxygenase				J Med Chem 37: 512-8 (1994) BindingDB Entry DOI: 10.7270/Q2J965FV
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50040420 (4-Methoxy-4-[3-(naphthalen-2-yloxymethyl)-phenyl]-...) Show SMILES COC1(CCOCC1)c1cccc(COc2ccc3ccccc3c2)c1 Show InChI InChI=1S/C23H24O3/c1-24-23(11-13-25-14-12-23)21-8-4-5-18(15-21)17-26-22-10-9-19-6-2-3-7-20(19)16-22/h2-10,15-16H,11-14,17H2,1H3	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	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Max Planck Institute of Molecular Physiology Curated by ChEMBL					Assay Description Inhibition of 5-LOX				J Med Chem 55: 5989-6001 (2012) Article DOI: 10.1021/jm300288g BindingDB Entry DOI: 10.7270/Q2J38TPJ
					More data for this Ligand-Target Pair