BDBM50090961 CHEMBL3582016

SMILES: COC1CN(C1)c1ccc(nc1OCC1CC1)C(=O)NCC1(O)CCCCC1

InChI Key: InChIKey=LIZJLQKIVJCYJD-UHFFFAOYSA-N

Data: 2 KI  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 4 hits for monomerid = 50090961   

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 (MOUSE)	BDBM50090961 (CHEMBL3582016) Show SMILES COC1CN(C1)c1ccc(nc1OCC1CC1)C(=O)NCC1(O)CCCCC1 Show InChI InChI=1S/C21H31N3O4/c1-27-16-11-24(12-16)18-8-7-17(23-20(18)28-13-15-5-6-15)19(25)22-14-21(26)9-3-2-4-10-21/h7-8,15-16,26H,2-6,9-14H2,1H3,(H,22,25)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.23E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Displacement of [3H]CP-55,940 from mouse CB2 receptor expressed in CHO cell membranes				J Med Chem 58: 4266-77 (2015) Article DOI: 10.1021/acs.jmedchem.5b00283 BindingDB Entry DOI: 10.7270/Q2542QBG
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50090961 (CHEMBL3582016) Show SMILES COC1CN(C1)c1ccc(nc1OCC1CC1)C(=O)NCC1(O)CCCCC1 Show InChI InChI=1S/C21H31N3O4/c1-27-16-11-24(12-16)18-8-7-17(23-20(18)28-13-15-5-6-15)19(25)22-14-21(26)9-3-2-4-10-21/h7-8,15-16,26H,2-6,9-14H2,1H3,(H,22,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.87E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Displacement of [3H]CP-55,940 from human CB2 receptor expressed in CHO cell membranes				J Med Chem 58: 4266-77 (2015) Article DOI: 10.1021/acs.jmedchem.5b00283 BindingDB Entry DOI: 10.7270/Q2542QBG
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50090961 (CHEMBL3582016) Show SMILES COC1CN(C1)c1ccc(nc1OCC1CC1)C(=O)NCC1(O)CCCCC1 Show InChI InChI=1S/C21H31N3O4/c1-27-16-11-24(12-16)18-8-7-17(23-20(18)28-13-15-5-6-15)19(25)22-14-21(26)9-3-2-4-10-21/h7-8,15-16,26H,2-6,9-14H2,1H3,(H,22,25)	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	1.29E+3	n/a	n/a	n/a	n/a
Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Activity at human CB2 receptor expressed in CHO cells assessed as cAMP accumulation incubated for 30 mins by time-resolved FRET assay				J Med Chem 58: 4266-77 (2015) Article DOI: 10.1021/acs.jmedchem.5b00283 BindingDB Entry DOI: 10.7270/Q2542QBG
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50090961 (CHEMBL3582016) Show SMILES COC1CN(C1)c1ccc(nc1OCC1CC1)C(=O)NCC1(O)CCCCC1 Show InChI InChI=1S/C21H31N3O4/c1-27-16-11-24(12-16)18-8-7-17(23-20(18)28-13-15-5-6-15)19(25)22-14-21(26)9-3-2-4-10-21/h7-8,15-16,26H,2-6,9-14H2,1H3,(H,22,25)	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	>1.00E+4	n/a	n/a	n/a	n/a
Institute of Pharmaceutical Sciences Curated by ChEMBL					Assay Description Activity at human CB1 receptor expressed in CHO cells assessed as cAMP accumulation incubated for 30 mins by time-resolved FRET assay				J Med Chem 58: 4266-77 (2015) Article DOI: 10.1021/acs.jmedchem.5b00283 BindingDB Entry DOI: 10.7270/Q2542QBG
					More data for this Ligand-Target Pair