BDBM50322841 CHEMBL1210412::rac-N-((1-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl)-N-(1-(2-morpholinoethyl)cyclohexyl)cyclohexanecarboxamide

SMILES: Cn1c2ccccc2cc(CN(C(=O)C2CCCCC2)C2(CCN3CCOCC3)CCCCC2)c1=O

InChI Key: InChIKey=CFAZSYQAAMGBBF-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 50322841   

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
Neuropeptide S receptor (Homo sapiens (Human))	BDBM50322841 (CHEMBL1210412 | rac-N-((1-methyl-2-oxo-1,2-dihydro...) Show SMILES Cn1c2ccccc2cc(CN(C(=O)C2CCCCC2)C2(CCN3CCOCC3)CCCCC2)c1=O Show InChI InChI=1S/C30H43N3O3/c1-31-27-13-7-6-12-25(27)22-26(28(31)34)23-33(29(35)24-10-4-2-5-11-24)30(14-8-3-9-15-30)16-17-32-18-20-36-21-19-32/h6-7,12-13,22,24H,2-5,8-11,14-21,23H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	398	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity at human recombinant NPS receptor expressed in CHOK1 cells assessed as inhibition of NPS-induced calcium mobilization by FLIPR as...				Bioorg Med Chem Lett 20: 4700-3 (2010) Article DOI: 10.1016/j.bmcl.2010.04.143 BindingDB Entry DOI: 10.7270/Q2PR7W6H
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