BDBM50304306 CHEMBL607088::trans-3-Oxo-N-(3-phenyl-1H-pyrazol-5-yl)-3H-spiro[4-aza-2-benzofuran-1,1'-cyclohexane]-4'-carboxamide

SMILES: O=C(Nc1cc(n[nH]1)-c1ccccc1)[C@H]1CC[C@@]2(CC1)OC(=O)c1ncccc21

InChI Key: InChIKey=BJVKVLNTJRCSND-VVONHTQRSA-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 = 50304306   

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))	BDBM50304306 (CHEMBL607088 | trans-3-Oxo-N-(3-phenyl-1H-pyrazol-...) Show SMILES O=C(Nc1cc(n[nH]1)-c1ccccc1)[C@H]1CC[C@@]2(CC1)OC(=O)c1ncccc21 |r,wU:17.22,wD:14.15,(10.49,-8.76,;11.26,-10.1,;12.8,-10.1,;13.67,-11.37,;13.16,-12.83,;14.39,-13.76,;15.65,-12.89,;15.21,-11.41,;14.35,-15.3,;13,-16.03,;12.96,-17.57,;14.28,-18.38,;15.64,-17.63,;15.67,-16.09,;10.48,-11.43,;8.94,-11.43,;8.17,-12.77,;8.94,-14.09,;10.48,-14.09,;11.25,-12.77,;9.86,-15.35,;8.95,-16.61,;9.43,-18.07,;7.48,-16.13,;6.14,-16.9,;4.81,-16.13,;4.81,-14.58,;6.14,-13.81,;7.48,-14.58,)| Show InChI InChI=1S/C22H20N4O3/c27-20(24-18-13-17(25-26-18)14-5-2-1-3-6-14)15-8-10-22(11-9-15)16-7-4-12-23-19(16)21(28)29-22/h1-7,12-13,15H,8-11H2,(H2,24,25,26,27)/t15-,22-	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.40	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