BDBM50016986 7-Chloro-2-(4-methoxy-benzyl)-3-methyl-5-propyl-benzofuran-4-ol::CHEMBL17815

SMILES: CCCc1cc(Cl)c2oc(Cc3ccc(OC)cc3)c(C)c2c1O

InChI Key: InChIKey=PLRQEJPVGOQVSJ-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 50016986   

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))	BDBM50016986 (7-Chloro-2-(4-methoxy-benzyl)-3-methyl-5-propyl-be...) Show SMILES CCCc1cc(Cl)c2oc(Cc3ccc(OC)cc3)c(C)c2c1O Show InChI InChI=1S/C20H21ClO3/c1-4-5-14-11-16(21)20-18(19(14)22)12(2)17(24-20)10-13-6-8-15(23-3)9-7-13/h6-9,11,22H,4-5,10H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Canada Inc. Curated by ChEMBL					Assay Description Inhibition of 5-lipoxygenase reaction catalyzed by purified enzyme from porcine leukocytes				J Med Chem 32: 1190-7 (1989) BindingDB Entry DOI: 10.7270/Q2ST7NVR
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Rattus norvegicus)	BDBM50016986 (7-Chloro-2-(4-methoxy-benzyl)-3-methyl-5-propyl-be...) Show SMILES CCCc1cc(Cl)c2oc(Cc3ccc(OC)cc3)c(C)c2c1O Show InChI InChI=1S/C20H21ClO3/c1-4-5-14-11-16(21)20-18(19(14)22)12(2)17(24-20)10-13-6-8-15(23-3)9-7-13/h6-9,11,22H,4-5,10H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Canada Inc. Curated by ChEMBL					Assay Description Concentration required for 50 % inhibition of arachidonic acid oxidation by rat 5-lipoxygenase				J Med Chem 32: 1190-7 (1989) BindingDB Entry DOI: 10.7270/Q2ST7NVR
					More data for this Ligand-Target Pair
Arachidonate 15-lipoxygenase (Homo sapiens (Human))	BDBM50016986 (7-Chloro-2-(4-methoxy-benzyl)-3-methyl-5-propyl-be...) Show SMILES CCCc1cc(Cl)c2oc(Cc3ccc(OC)cc3)c(C)c2c1O Show InChI InChI=1S/C20H21ClO3/c1-4-5-14-11-16(21)20-18(19(14)22)12(2)17(24-20)10-13-6-8-15(23-3)9-7-13/h6-9,11,22H,4-5,10H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Canada Inc. Curated by ChEMBL					Assay Description Inhibition of partially purified 15-lipoxygenase from human leukocytes				J Med Chem 32: 1190-7 (1989) BindingDB Entry DOI: 10.7270/Q2ST7NVR
					More data for this Ligand-Target Pair
Arachidonate 5-lipoxygenase (Homo sapiens (Human))	BDBM50016986 (7-Chloro-2-(4-methoxy-benzyl)-3-methyl-5-propyl-be...) Show SMILES CCCc1cc(Cl)c2oc(Cc3ccc(OC)cc3)c(C)c2c1O Show InChI InChI=1S/C20H21ClO3/c1-4-5-14-11-16(21)20-18(19(14)22)12(2)17(24-20)10-13-6-8-15(23-3)9-7-13/h6-9,11,22H,4-5,10H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Canada Inc. Curated by ChEMBL					Assay Description Concentration required for 50 % inhibition of leukotriene B4 production in human PMN compared with controls in the absence of compound				J Med Chem 32: 1190-7 (1989) BindingDB Entry DOI: 10.7270/Q2ST7NVR
					More data for this Ligand-Target Pair
Arachidonate 12-lipoxygenase (Sus scrofa)	BDBM50016986 (7-Chloro-2-(4-methoxy-benzyl)-3-methyl-5-propyl-be...) Show SMILES CCCc1cc(Cl)c2oc(Cc3ccc(OC)cc3)c(C)c2c1O Show InChI InChI=1S/C20H21ClO3/c1-4-5-14-11-16(21)20-18(19(14)22)12(2)17(24-20)10-13-6-8-15(23-3)9-7-13/h6-9,11,22H,4-5,10H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Canada Inc. Curated by ChEMBL					Assay Description Inhibitory activity of the compound towards porcine 12-lipoxygenase				J Med Chem 32: 1190-7 (1989) BindingDB Entry DOI: 10.7270/Q2ST7NVR
					More data for this Ligand-Target Pair
Lipoxygenase-1 (Glycine max (soybean))	BDBM50016986 (7-Chloro-2-(4-methoxy-benzyl)-3-methyl-5-propyl-be...) Show SMILES CCCc1cc(Cl)c2oc(Cc3ccc(OC)cc3)c(C)c2c1O Show InChI InChI=1S/C20H21ClO3/c1-4-5-14-11-16(21)20-18(19(14)22)12(2)17(24-20)10-13-6-8-15(23-3)9-7-13/h6-9,11,22H,4-5,10H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Canada Inc. Curated by ChEMBL					Assay Description Inhibitory activity of the compound towards soybean lipoxygenase				J Med Chem 32: 1190-7 (1989) BindingDB Entry DOI: 10.7270/Q2ST7NVR
					More data for this Ligand-Target Pair