Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Substance-P receptor' and Ligand = 'BDBM50214641'   

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))	BDBM50214641 (CHEMBL291650) Show SMILES CN(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(=O)N1CC(=O)Nc2ccccc2C1CN1CCOCC1 Show InChI InChI=1S/C25H26F6N4O3/c1-33(13-16-10-17(24(26,27)28)12-18(11-16)25(29,30)31)23(37)35-15-22(36)32-20-5-3-2-4-19(20)21(35)14-34-6-8-38-9-7-34/h2-5,10-12,21H,6-9,13-15H2,1H3,(H,32,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	794	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for affinity against NK-1(Neurokinin-1) receptor expressed as pKi				Bioorg Med Chem Lett 7: 2037-2042 (1997) Article DOI: 10.1016/S0960-894X(97)00353-3 BindingDB Entry DOI: 10.7270/Q21836GK
					More data for this Ligand-Target Pair