Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Substance-P receptor' and Ligand = 'BDBM50041562'   

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))	BDBM50041562 (CHEMBL3358423) Show SMILES O=C(N[C@@H](Cc1ccccc1)C(=O)NNC(=O)c1ccccc1)OCc1ccccc1 |r| Show InChI InChI=1S/C24H23N3O4/c28-22(20-14-8-3-9-15-20)26-27-23(29)21(16-18-10-4-1-5-11-18)25-24(30)31-17-19-12-6-2-7-13-19/h1-15,21H,16-17H2,(H,25,30)(H,26,28)(H,27,29)/t21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.5	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Displacement of [3H]-SP1-7 from NK1 receptor (unknown origin) by scintillation counting analysis				ACS Med Chem Lett 5: 1272-7 (2014) Article DOI: 10.1021/ml5002954 BindingDB Entry DOI: 10.7270/Q2Q52R7V
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