null

SMILES: CC(C)(C)c1nc(NCC(F)(F)CO)c2cc(-c3ccc(Cl)cc3)c(nc2n1)-c1ccccc1Cl

InChI Key: InChIKey=UGOQZVLEHPFGMP-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50259336   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50259336 (3-(2-tert-butyl-7-(2-chlorophenyl)-6-(4-chlorophen...) Show SMILES CC(C)(C)c1nc(NCC(F)(F)CO)c2cc(-c3ccc(Cl)cc3)c(nc2n1)-c1ccccc1Cl Show InChI InChI=1S/C26H24Cl2F2N4O/c1-25(2,3)24-33-22(31-13-26(29,30)14-35)19-12-18(15-8-10-16(27)11-9-15)21(32-23(19)34-24)17-6-4-5-7-20(17)28/h4-12,35H,13-14H2,1-3H3,(H,31,32,33,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human cannabinoid CB2R expressed in CHO cells				Bioorg Med Chem Lett 19: 2591-4 (2009) Article DOI: 10.1016/j.bmcl.2009.03.005 BindingDB Entry DOI: 10.7270/Q2PK0G1X
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50259336 (3-(2-tert-butyl-7-(2-chlorophenyl)-6-(4-chlorophen...) Show SMILES CC(C)(C)c1nc(NCC(F)(F)CO)c2cc(-c3ccc(Cl)cc3)c(nc2n1)-c1ccccc1Cl Show InChI InChI=1S/C26H24Cl2F2N4O/c1-25(2,3)24-33-22(31-13-26(29,30)14-35)19-12-18(15-8-10-16(27)11-9-15)21(32-23(19)34-24)17-6-4-5-7-20(17)28/h4-12,35H,13-14H2,1-3H3,(H,31,32,33,34)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.5	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inverse agonist activity at human cannabinoid CB1R expressed in CHO cells assessed as effect on cAMP accumulation				Bioorg Med Chem Lett 19: 2591-4 (2009) Article DOI: 10.1016/j.bmcl.2009.03.005 BindingDB Entry DOI: 10.7270/Q2PK0G1X
					More data for this Ligand-Target Pair