Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Substance-P receptor' and Ligand = 'BDBM50287358'   

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
Substance-P receptor (Homo sapiens (Human))	BDBM50287358 (CHEMBL288340 | N-[2-(3,5-Bis-trifluoromethyl-pheny...) Show SMILES FC(F)(F)c1cc(CCNC(=O)CC(c2ccccc2)c2ccccc2)cc(c1)C(F)(F)F Show InChI InChI=1S/C25H21F6NO/c26-24(27,28)20-13-17(14-21(15-20)25(29,30)31)11-12-32-23(33)16-22(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-10,13-15,22H,11-12,16H2,(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	112	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Affinity for human NK1 receptor determined by displacement of [125I]- Substance P from human NK1 receptor in CHO cells				Bioorg Med Chem Lett 6: 1585-1588 (1996) Article DOI: 10.1016/S0960-894X(96)00280-6 BindingDB Entry DOI: 10.7270/Q24X57RT
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