Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 378.5 BDBM50308971

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits 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
Fatty-acid amide hydrolase 1 [30-579] (Rattus norvegicus (rat))	BDBM50308971 (1-Benzimidazol-1-yl-3-(4-octylphenoxy)propan-2-one...) Show SMILES CCCCCCCCc1ccc(OCC(=O)Cn2cnc3ccccc23)cc1 Show InChI InChI=1S/C24H30N2O2/c1-2-3-4-5-6-7-10-20-13-15-22(16-14-20)28-18-21(27)17-26-19-25-23-11-8-9-12-24(23)26/h8-9,11-16,19H,2-7,10,17-18H2,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
University of M£nster Curated by ChEMBL					Assay Description Inhibition of FAAH in rat brain microsomes using N-(2-hydroxyethyl)-4-pyren-1-ylbutanamide as substrate after 60 mins by fluorescence-based reversed ...				Bioorg Med Chem 25: 825-837 (2017) Article DOI: 10.1016/j.bmc.2016.11.025 BindingDB Entry DOI: 10.7270/Q20C4XQH
					More data for this Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579] (Rattus norvegicus (rat))	BDBM50308971 (1-Benzimidazol-1-yl-3-(4-octylphenoxy)propan-2-one...) Show SMILES CCCCCCCCc1ccc(OCC(=O)Cn2cnc3ccccc23)cc1 Show InChI InChI=1S/C24H30N2O2/c1-2-3-4-5-6-7-10-20-13-15-22(16-14-20)28-18-21(27)17-26-19-25-23-11-8-9-12-24(23)26/h8-9,11-16,19H,2-7,10,17-18H2,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of M£nster Curated by ChEMBL					Assay Description Inhibition of FAAH from rat brain microsomes by RP-HPLC				Bioorg Med Chem 18: 945-52 (2010) Article DOI: 10.1016/j.bmc.2009.11.028 BindingDB Entry DOI: 10.7270/Q2N016MF
					More data for this Ligand-Target Pair
Cytosolic phospholipase A2 (Homo sapiens (Human))	BDBM50308971 (1-Benzimidazol-1-yl-3-(4-octylphenoxy)propan-2-one...) Show SMILES CCCCCCCCc1ccc(OCC(=O)Cn2cnc3ccccc23)cc1 Show InChI InChI=1S/C24H30N2O2/c1-2-3-4-5-6-7-10-20-13-15-22(16-14-20)28-18-21(27)17-26-19-25-23-11-8-9-12-24(23)26/h8-9,11-16,19H,2-7,10,17-18H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of M£nster Curated by ChEMBL					Assay Description Inhibition of cPLA2 from human platelets by RP-HPLC				Bioorg Med Chem 18: 945-52 (2010) Article DOI: 10.1016/j.bmc.2009.11.028 BindingDB Entry DOI: 10.7270/Q2N016MF
					More data for this Ligand-Target Pair