BDBM50304304 CHEMBL596031::trans-3-Oxo-N-(5-phenylpyrazin-2-yl)-3H-spiro[4-aza-2-benzofuran-1,1'-cyclohexane]-4'-carboxamide

SMILES: O=C(Nc1cnc(cn1)-c1ccccc1)[C@H]1CC[C@@]2(CC1)OC(=O)c1ncccc21

InChI Key: InChIKey=SCZBQMAVFTUMTR-QXONSOMPSA-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 = 50304304   

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 Y receptor type 5 ( NPY Y5) (Homo sapiens (Human))	BDBM50304304 (CHEMBL596031 | trans-3-Oxo-N-(5-phenylpyrazin-2-yl...) Show SMILES O=C(Nc1cnc(cn1)-c1ccccc1)[C@H]1CC[C@@]2(CC1)OC(=O)c1ncccc21 |r,wU:18.23,wD:15.16,(11.32,4.93,;12.09,3.6,;13.63,3.6,;14.4,2.26,;13.62,.93,;14.39,-.4,;15.93,-.41,;16.7,.94,;15.93,2.26,;16.7,-1.73,;15.93,-3.07,;16.69,-4.4,;18.24,-4.4,;19.01,-3.06,;18.23,-1.73,;11.32,2.26,;9.78,2.26,;9,.93,;9.78,-.4,;11.32,-.4,;12.08,.93,;10.7,-1.65,;9.78,-2.91,;10.26,-4.37,;8.31,-2.43,;6.98,-3.2,;5.64,-2.43,;5.64,-.89,;6.97,-.12,;8.31,-.88,)| Show InChI InChI=1S/C23H20N4O3/c28-21(27-19-14-25-18(13-26-19)15-5-2-1-3-6-15)16-8-10-23(11-9-16)17-7-4-12-24-20(17)22(29)30-23/h1-7,12-14,16H,8-11H2,(H,26,27,28)/t16-,23-	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Displacement of [125I]PYY from human recombinant Y5 receptor				Bioorg Med Chem 17: 6971-82 (2009) Article DOI: 10.1016/j.bmc.2009.08.019 BindingDB Entry DOI: 10.7270/Q2P26Z62
					More data for this Ligand-Target Pair