BDBM50340998 CHEMBL1762417::N-(5-tert-butylisoxazol-3-yl)-4-(tetrahydro-2N-(5-tert-butylisoxazol-3-yl)-4-(tetrahydro-2H-pyran-3-carbonyl)-1,4-diazepane-1-carboxamide

SMILES: CC(C)(C)c1cc(NC(=O)N2CCCN(CC2)C(=O)C2CCCOC2)no1

InChI Key: InChIKey=XETLDNBDDCFPRP-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 = 50340998   

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))	BDBM50340998 (CHEMBL1762417 | N-(5-tert-butylisoxazol-3-yl)-4-(t...) Show SMILES CC(C)(C)c1cc(NC(=O)N2CCCN(CC2)C(=O)C2CCCOC2)no1 Show InChI InChI=1S/C19H30N4O4/c1-19(2,3)15-12-16(21-27-15)20-18(25)23-8-5-7-22(9-10-23)17(24)14-6-4-11-26-13-14/h12,14H,4-11,13H2,1-3H3,(H,20,21,25)	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	>2.00E+4	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human CB1 receptor transfected in CHO cells assessed as inhibition of forskolin-stimulated cAMP production				Bioorg Med Chem Lett 21: 2011-6 (2011) Article DOI: 10.1016/j.bmcl.2011.02.017 BindingDB Entry DOI: 10.7270/Q2KK9C2M
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50340998 (CHEMBL1762417 | N-(5-tert-butylisoxazol-3-yl)-4-(t...) Show SMILES CC(C)(C)c1cc(NC(=O)N2CCCN(CC2)C(=O)C2CCCOC2)no1 Show InChI InChI=1S/C19H30N4O4/c1-19(2,3)15-12-16(21-27-15)20-18(25)23-8-5-7-22(9-10-23)17(24)14-6-4-11-26-13-14/h12,14H,4-11,13H2,1-3H3,(H,20,21,25)	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	2.05E+3	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at human CB2 receptor transfected in CHO cells assessed as inhibition of forskolin-stimulated cAMP production				Bioorg Med Chem Lett 21: 2011-6 (2011) Article DOI: 10.1016/j.bmcl.2011.02.017 BindingDB Entry DOI: 10.7270/Q2KK9C2M
					More data for this Ligand-Target Pair