Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50056463'   

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
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50056463 ((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid (3...) Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCCO Show InChI InChI=1S/C23H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)24-21-19-22-25/h6-7,9-10,12-13,15-16,25H,2-5,8,11,14,17-22H2,1H3,(H,24,26)/b7-6-,10-9-,13-12-,16-15-	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hebrew University Curated by ChEMBL					Assay Description Binding affinity against the cannabinoid receptor				J Med Chem 40: 659-67 (1997) Article DOI: 10.1021/jm960752x BindingDB Entry DOI: 10.7270/Q2JS9R3C
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50056463 ((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid (3...) Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCCO Show InChI InChI=1S/C23H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)24-21-19-22-25/h6-7,9-10,12-13,15-16,25H,2-5,8,11,14,17-22H2,1H3,(H,24,26)/b7-6-,10-9-,13-12-,16-15-	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hebrew University Curated by ChEMBL					Assay Description In vitro binding affinity was determined against rat brain Cannabinoid receptor 1				J Med Chem 40: 659-67 (1997) Article DOI: 10.1021/jm960752x BindingDB Entry DOI: 10.7270/Q2JS9R3C
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50056463 ((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid (3...) Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCCO Show InChI InChI=1S/C23H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)24-21-19-22-25/h6-7,9-10,12-13,15-16,25H,2-5,8,11,14,17-22H2,1H3,(H,24,26)/b7-6-,10-9-,13-12-,16-15-	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	189	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hebrew University Curated by ChEMBL					Assay Description Binding affinity against the cannabinoid receptor in the presence of PMSF				J Med Chem 40: 659-67 (1997) Article DOI: 10.1021/jm960752x BindingDB Entry DOI: 10.7270/Q2JS9R3C
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50056463 ((5Z,8Z,11Z,14Z)-Icosa-5,8,11,14-tetraenoic acid (3...) Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCCCO Show InChI InChI=1S/C23H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)24-21-19-22-25/h6-7,9-10,12-13,15-16,25H,2-5,8,11,14,17-22H2,1H3,(H,24,26)/b7-6-,10-9-,13-12-,16-15-	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	364	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hebrew University Curated by ChEMBL					Assay Description Binding affinity against the cloned human Cannabinoid receptor 1				J Med Chem 40: 659-67 (1997) Article DOI: 10.1021/jm960752x BindingDB Entry DOI: 10.7270/Q2JS9R3C
					More data for this Ligand-Target Pair