BDBM50304315 CHEMBL593465::trans-3-Oxo-N-(2-phenyl-2H-1,2,3-triazol-4-yl)-3Hspiro[6-aza-2-benzofuran-1,1'-cyclohexane]-4'-carboxamide

SMILES: O=C(Nc1cnn(n1)-c1ccccc1)[C@H]1CC[C@@]2(CC1)OC(=O)c1ccncc21

InChI Key: InChIKey=LKMBZBSOJLVTSZ-HNSKJHPRSA-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 = 50304315   

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))	BDBM50304315 (CHEMBL593465 | trans-3-Oxo-N-(2-phenyl-2H-1,2,3-tr...) Show SMILES O=C(Nc1cnn(n1)-c1ccccc1)[C@H]1CC[C@@]2(CC1)OC(=O)c1ccncc21 |r,wU:17.22,wD:14.15,(-4.09,-21.75,;-3.32,-23.08,;-1.78,-23.08,;-.88,-24.33,;.67,-24.33,;1.14,-25.79,;-.1,-26.7,;-1.35,-25.79,;-.1,-28.23,;-1.44,-29,;-1.44,-30.53,;-.11,-31.31,;1.23,-30.53,;1.23,-28.99,;-4.09,-24.41,;-5.63,-24.41,;-6.41,-25.75,;-5.63,-27.07,;-4.09,-27.07,;-3.33,-25.75,;-4.71,-28.33,;-5.62,-29.59,;-5.15,-31.05,;-7.1,-29.11,;-8.43,-29.88,;-9.77,-29.11,;-9.76,-27.56,;-8.43,-26.79,;-7.1,-27.56,)| Show InChI InChI=1S/C21H19N5O3/c27-19(24-18-13-23-26(25-18)15-4-2-1-3-5-15)14-6-9-21(10-7-14)17-12-22-11-8-16(17)20(28)29-21/h1-5,8,11-14H,6-7,9-10H2,(H,24,25,27)/t14-,21-	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.890	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