Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50541728'   

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 2 (Homo sapiens (Human))	BDBM50541728 (CHEMBL4639191) Show SMILES CN1N=CC2C1C(O)=C(C(=O)NC13CC4CC(CC(O)(C4)C1)C3)C(=O)N2CCCCF |c:2,t:8,TLB:15:16:14.13.20:21,THB:15:14:22.16.17:21,17:16:13:20.18.21,17:18:22.16.15:13,19:18:22.16.15:13| Show InChI InChI=1S/C22H31FN4O4/c1-26-17-15(11-24-26)27(5-3-2-4-23)20(30)16(18(17)28)19(29)25-21-7-13-6-14(8-21)10-22(31,9-13)12-21/h11,13-15,17,28,31H,2-10,12H2,1H3,(H,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Displacement of [3H]-CP-55,940 from recombinant human CB2R expressed in HEK293 cell membranes				J Med Chem 63: 7369-7391 (2020) Article DOI: 10.1021/acs.jmedchem.0c00595 BindingDB Entry DOI: 10.7270/Q2N01B3C
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50541728 (CHEMBL4639191) Show SMILES CN1N=CC2C1C(O)=C(C(=O)NC13CC4CC(CC(O)(C4)C1)C3)C(=O)N2CCCCF |c:2,t:8,TLB:15:16:14.13.20:21,THB:15:14:22.16.17:21,17:16:13:20.18.21,17:18:22.16.15:13,19:18:22.16.15:13| Show InChI InChI=1S/C22H31FN4O4/c1-26-17-15(11-24-26)27(5-3-2-4-23)20(30)16(18(17)28)19(29)25-21-7-13-6-14(8-21)10-22(31,9-13)12-21/h11,13-15,17,28,31H,2-10,12H2,1H3,(H,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	72	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Agonist activity at recombinant human CB2R expressed in CHOK1 cells assessed as inhibition of NKH477-stimulated intracellular cAMP levels after 30 mi...				J Med Chem 63: 7369-7391 (2020) Article DOI: 10.1021/acs.jmedchem.0c00595 BindingDB Entry DOI: 10.7270/Q2N01B3C
					More data for this Ligand-Target Pair