Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50172545'   

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 (Mus musculus (Mouse))	BDBM50172545 ((2-Iodo-phenyl)-[1-((S)-1-methyl-piperidin-2-ylmet...) Show SMILES CN1CCCCC1Cn1cc(C(=O)c2ccccc2I)c2ccccc12 Show InChI InChI=1S/C22H23IN2O/c1-24-13-7-6-8-16(24)14-25-15-19(17-9-3-5-12-21(17)25)22(26)18-10-2-4-11-20(18)23/h2-5,9-12,15-16H,6-8,13-14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northeastern University Curated by ChEMBL					Assay Description Binding affinity towards mouse hippocampal membranes cannabinoid receptor 1 using [131I]-(R)-8				J Med Chem 48: 6386-92 (2005) Article DOI: 10.1021/jm050135l BindingDB Entry DOI: 10.7270/Q21V5FQ7
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50172545 ((2-Iodo-phenyl)-[1-((S)-1-methyl-piperidin-2-ylmet...) Show SMILES CN1CCCCC1Cn1cc(C(=O)c2ccccc2I)c2ccccc12 Show InChI InChI=1S/C22H23IN2O/c1-24-13-7-6-8-16(24)14-25-15-19(17-9-3-5-12-21(17)25)22(26)18-10-2-4-11-20(18)23/h2-5,9-12,15-16H,6-8,13-14H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute on Drug Abuse Curated by ChEMBL					Assay Description In vitro binding affinity aganist rat cannabinoid receptor 1 using 0.5 nM [3H]-CP- 55940				J Med Chem 48: 5813-22 (2005) Article DOI: 10.1021/jm0502743 BindingDB Entry DOI: 10.7270/Q23X865M
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Mus musculus (Mouse))	BDBM50172545 ((2-Iodo-phenyl)-[1-((S)-1-methyl-piperidin-2-ylmet...) Show SMILES CN1CCCCC1Cn1cc(C(=O)c2ccccc2I)c2ccccc12 Show InChI InChI=1S/C22H23IN2O/c1-24-13-7-6-8-16(24)14-25-15-19(17-9-3-5-12-21(17)25)22(26)18-10-2-4-11-20(18)23/h2-5,9-12,15-16H,6-8,13-14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northeastern University Curated by ChEMBL					Assay Description Binding affinity towards mouse hippocampal membranes cannabinoid receptor 1 using [3H]SR-141,716A				J Med Chem 48: 6386-92 (2005) Article DOI: 10.1021/jm050135l BindingDB Entry DOI: 10.7270/Q21V5FQ7
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50172545 ((2-Iodo-phenyl)-[1-((S)-1-methyl-piperidin-2-ylmet...) Show SMILES CN1CCCCC1Cn1cc(C(=O)c2ccccc2I)c2ccccc12 Show InChI InChI=1S/C22H23IN2O/c1-24-13-7-6-8-16(24)14-25-15-19(17-9-3-5-12-21(17)25)22(26)18-10-2-4-11-20(18)23/h2-5,9-12,15-16H,6-8,13-14H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northeastern University Curated by ChEMBL					Assay Description Binding affinity towards rat forebrain cannabinoid receptor 1 using [3H]CP-55940				J Med Chem 48: 6386-92 (2005) Article DOI: 10.1021/jm050135l BindingDB Entry DOI: 10.7270/Q21V5FQ7
					More data for this Ligand-Target Pair