Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 538.6 BDBM50337394

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))	BDBM50337394 ((1S,2R)-2-((4-acetamido-4-phenylpiperidin-1-yl)met...) Show SMILES CN(Cc1ccc(F)cc1)C(=O)[C@]1(C[C@H]1CN1CCC(CC1)(NC(C)=O)c1ccccc1)c1cccc(c1)C#N |r| Show InChI InChI=1S/C33H35FN4O2/c1-24(39)36-32(27-8-4-3-5-9-27)15-17-38(18-16-32)23-29-20-33(29,28-10-6-7-26(19-28)21-35)31(40)37(2)22-25-11-13-30(34)14-12-25/h3-14,19,29H,15-18,20,22-23H2,1-2H3,(H,36,39)/t29-,33+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S Curated by ChEMBL					Assay Description Displacement of [3H]Lu AE93103 from human NK3 receptor expressed in BHK cells				Bioorg Med Chem Lett 21: 1498-501 (2011) Article DOI: 10.1016/j.bmcl.2010.12.135 BindingDB Entry DOI: 10.7270/Q23J3D8R
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