BDBM50214734 CHEMBL302163

SMILES: FC(F)(F)c1cc(CNC(=O)N2CC(=O)Nc3ccccc3C2c2ccccc2)cc(c1)C(F)(F)F

InChI Key: InChIKey=XUYBQECRTQVEHH-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50214734   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neurokinin 1 receptor (Homo sapiens (Human))	BDBM50214734 (CHEMBL302163) Show SMILES FC(F)(F)c1cc(CNC(=O)N2CC(=O)Nc3ccccc3C2c2ccccc2)cc(c1)C(F)(F)F Show InChI InChI=1S/C25H19F6N3O2/c26-24(27,28)17-10-15(11-18(12-17)25(29,30)31)13-32-23(36)34-14-21(35)33-20-9-5-4-8-19(20)22(34)16-6-2-1-3-7-16/h1-12,22H,13-14H2,(H,32,36)(H,33,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	631	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