Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50249592'   

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))	BDBM50249592 (CHEMBL4061179) Show SMILES CCCCCn1cc(-c2cn(nn2)C23CC4CC(CC(C4)C2)C3)c(=O)c2cc(ccc12)-c1ccco1 |TLB:10:13:16:20.18.19,THB:18:17:14:20.19.21,18:19:16.17.22:14,21:19:16:22.13.14,21:13:16:20.18.19| Show InChI InChI=1S/C30H34N4O2/c1-2-3-4-9-33-18-25(29(35)24-14-23(7-8-27(24)33)28-6-5-10-36-28)26-19-34(32-31-26)30-15-20-11-21(16-30)13-22(12-20)17-30/h5-8,10,14,18-22H,2-4,9,11-13,15-17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	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
TBA					Assay Description Displacement of [3H]CP-55940 from human CB2 receptor expressed in HEK cells by competitive binding assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c00530 BindingDB Entry DOI: 10.7270/Q2W95DW9
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50249592 (CHEMBL4061179) Show SMILES CCCCCn1cc(-c2cn(nn2)C23CC4CC(CC(C4)C2)C3)c(=O)c2cc(ccc12)-c1ccco1 |TLB:10:13:16:20.18.19,THB:18:17:14:20.19.21,18:19:16.17.22:14,21:19:16:22.13.14,21:13:16:20.18.19| Show InChI InChI=1S/C30H34N4O2/c1-2-3-4-9-33-18-25(29(35)24-14-23(7-8-27(24)33)28-6-5-10-36-28)26-19-34(32-31-26)30-15-20-11-21(16-30)13-22(12-20)17-30/h5-8,10,14,18-22H,2-4,9,11-13,15-17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	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
Dipartimento di Farmacia-Scienze del Farmaco, Università degli Studi di Bari Aldo Moro , Via Orabona 4, 70125, Bari, Italy. Curated by ChEMBL					Assay Description Displacement of [35S]GTPgammaS from human recombinant CB2 receptor expressed in CHO cells after 60 min by liquid scintillation spectrometry assay				J Med Chem 60: 9913-9931 (2017) Article DOI: 10.1021/acs.jmedchem.7b00155 BindingDB Entry DOI: 10.7270/Q2639S5P
					More data for this Ligand-Target Pair