Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 452.5 BDBM430840

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))	BDBM430840 ((3-(3-phenyl-1H-pyrazol-5-yl)-5,6-dihydro-[1,2,4]t...) Show SMILES O=C(N1CCn2c(C1)nnc2-c1cc(n[nH]1)-c1ccccc1)c1ccc(cc1)-c1cccs1 Show InChI InChI=1S/C25H20N6OS/c32-25(19-10-8-18(9-11-19)22-7-4-14-33-22)30-12-13-31-23(16-30)28-29-24(31)21-15-20(26-27-21)17-5-2-1-3-6-17/h1-11,14-15H,12-13,16H2,(H,26,27)	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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