Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50233616'   

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 (Rattus norvegicus (rat))	BDBM50233616 (CHEMBL4071457 | US10882838, Example 1.27) Show SMILES [H][C@@]12CC(C)=CC[C@@]1([H])C(C)(C)Oc1cc(CC(=O)OCCCCBr)cc(O)c21 |r,c:4| Show InChI InChI=1S/C22H29BrO4/c1-14-6-7-17-16(10-14)21-18(24)11-15(12-19(21)27-22(17,2)3)13-20(25)26-9-5-4-8-23/h6,11-12,16-17,24H,4-5,7-10,13H2,1-3H3/t16-,17-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	2.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NORTHEASTERN UNIVERSITY US Patent					Assay Description All the cannabinoids discussed in this invention are tested for their ability to bind to CB1 and CB2 receptors using membranes from rat brain or HEK2...				US Patent US10882838 (2021) BindingDB Entry DOI: 10.7270/Q29S1V4V
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Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50233616 (CHEMBL4071457 | US10882838, Example 1.27) Show SMILES [H][C@@]12CC(C)=CC[C@@]1([H])C(C)(C)Oc1cc(CC(=O)OCCCCBr)cc(O)c21 |r,c:4| Show InChI InChI=1S/C22H29BrO4/c1-14-6-7-17-16(10-14)21-18(24)11-15(12-19(21)27-22(17,2)3)13-20(25)26-9-5-4-8-23/h6,11-12,16-17,24H,4-5,7-10,13H2,1-3H3/t16-,17-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Northeastern University Curated by ChEMBL					Assay Description Displacement of [3H]CP-55,940 from CB1 receptor in rat brain membranes by scintillation counting method				J Med Chem 58: 665-81 (2015) Article DOI: 10.1021/jm501165d BindingDB Entry DOI: 10.7270/Q2K076HR
					More data for this Ligand-Target Pair