BDBM50039496 CHEMBL3357338

SMILES: CCN1CCN(CC1)c1nc(C)nc2n(C(COC)COC)c(nc12)-c1ccccc1Cl

InChI Key: InChIKey=RNIPCZJSAUJLLI-UHFFFAOYSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50039496   

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 1 (Homo sapiens (Human))	BDBM50039496 (CHEMBL3357338) Show SMILES CCN1CCN(CC1)c1nc(C)nc2n(C(COC)COC)c(nc12)-c1ccccc1Cl Show InChI InChI=1S/C23H31ClN6O2/c1-5-28-10-12-29(13-11-28)22-20-23(26-16(2)25-22)30(17(14-31-3)15-32-4)21(27-20)18-8-6-7-9-19(18)24/h6-9,17H,5,10-15H2,1-4H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at human CB1 receptor expressed in Sf9 cells by [35S]-GTPgammaS binding assay				Bioorg Med Chem Lett 24: 5572-5 (2014) Article DOI: 10.1016/j.bmcl.2014.11.006 BindingDB Entry DOI: 10.7270/Q2R78GVW
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50039496 (CHEMBL3357338) Show SMILES CCN1CCN(CC1)c1nc(C)nc2n(C(COC)COC)c(nc12)-c1ccccc1Cl Show InChI InChI=1S/C23H31ClN6O2/c1-5-28-10-12-29(13-11-28)22-20-23(26-16(2)25-22)30(17(14-31-3)15-32-4)21(27-20)18-8-6-7-9-19(18)24/h6-9,17H,5,10-15H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	5	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at human CB2 receptor expressed in CHO cells by [35S]-GTPgammaS binding assay				Bioorg Med Chem Lett 24: 5572-5 (2014) Article DOI: 10.1016/j.bmcl.2014.11.006 BindingDB Entry DOI: 10.7270/Q2R78GVW
					More data for this Ligand-Target Pair