Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 437.5 BDBM430703

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neuromedin-K receptor (Homo sapiens (Human))	BDBM430703 ((3-(quinolin-2-yl)-5,6-dihydro-[1,2,4]triazolo[4,3...) Show SMILES O=C(N1CCn2c(C1)nnc2-c1ccc2ccccc2n1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C25H19N5OS/c31-25(19-9-7-18(8-10-19)22-6-3-15-32-22)29-13-14-30-23(16-29)27-28-24(30)21-12-11-17-4-1-2-5-20(17)26-21/h1-12,15H,13-14,16H2	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ogeda SA US Patent					Assay Description The ability of the compounds of the invention to inhibit the binding of the NK-3 receptor selective antagonist SB222200 was assessed by an in vitro r...				US Patent US10544150 (2020) BindingDB Entry DOI: 10.7270/Q2XW4N7G
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