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SMILES: C[C@@H]1CC[C@H](CN1C(=O)c1ccccc1C1CC1)n1cc(cn1)C(C)(C)O

InChI Key: InChIKey=AEKDZZFPYZIWGJ-CRAIPNDOSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 401862   

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
Orexin/Hypocretin receptor type 1 (Homo sapiens (Human))	BDBM401862 (2-(1-{(3R,6R)-1-[(2- Cyclopropylphenyl)carbonyl]-6...) Show SMILES C[C@@H]1CC[C@H](CN1C(=O)c1ccccc1C1CC1)n1cc(cn1)C(C)(C)O |r| Show InChI InChI=1S/C22H29N3O2/c1-15-8-11-18(25-13-17(12-23-25)22(2,3)27)14-24(15)21(26)20-7-5-4-6-19(20)16-9-10-16/h4-7,12-13,15-16,18,27H,8-11,14H2,1-3H3/t15-,18-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester					Assay Description For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...				J Med Chem 52: 7142-56 (2009) BindingDB Entry DOI: 10.7270/Q2S75JPN
					More data for this Ligand-Target Pair
Orexin/Hypocretin receptor type 1 (Rattus norvegicus (Rat))	BDBM401862 (2-(1-{(3R,6R)-1-[(2- Cyclopropylphenyl)carbonyl]-6...) Show SMILES C[C@@H]1CC[C@H](CN1C(=O)c1ccccc1C1CC1)n1cc(cn1)C(C)(C)O |r| Show InChI InChI=1S/C22H29N3O2/c1-15-8-11-18(25-13-17(12-23-25)22(2,3)27)14-24(15)21(26)20-7-5-4-6-19(20)16-9-10-16/h4-7,12-13,15-16,18,27H,8-11,14H2,1-3H3/t15-,18-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	25.5	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester					Assay Description For intracellular calcium measurements, Chinese hamster ovary (CHO) cells expressing the rat orexin-1 receptor or the human orexin-2 receptor, are gr...				J Med Chem 52: 7142-56 (2009) BindingDB Entry DOI: 10.7270/Q2S75JPN
					More data for this Ligand-Target Pair