Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Substance-P receptor' and Ligand = 'BDBM50284633'   

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))	BDBM50284633 (2-[3-(3,5-Bis-trifluoromethyl-benzyloxy)-2-phenyl-...) Show SMILES FC(F)(F)c1cc(CO[C@H]2CCC[C@H](CC(=O)NCc3cccnc3)[C@H]2c2ccccc2)cc(c1)C(F)(F)F Show InChI InChI=1S/C29H28F6N2O2/c30-28(31,32)23-12-20(13-24(15-23)29(33,34)35)18-39-25-10-4-9-22(27(25)21-7-2-1-3-8-21)14-26(38)37-17-19-6-5-11-36-16-19/h1-3,5-8,11-13,15-16,22,25,27H,4,9-10,14,17-18H2,(H,37,38)/t22-,25+,27-/m1/s1	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	3.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity towards Neurokinin -1(NK-1) receptor of human by using [125I]- Tyr8 substance P as a radioligand in CHO cells				Bioorg Med Chem Lett 5: 1345-1350 (1995) Article DOI: 10.1016/0960-894X(95)00220-N BindingDB Entry DOI: 10.7270/Q2416X13
					More data for this Ligand-Target Pair