BDBM50288956 CHEMBL348599::N-[2-(3,4-Dichloro-phenyl)-4-(4-hydroxy-4-phenyl-piperidin-1-yl)-butyl]-N-methyl-3-(3-trifluoromethyl-3H-diazirin-3-yl)-benzamide

SMILES:

InChI Key: InChIKey=BEEQXPRIGOACQA-UHFFFAOYSA-N

Data: 1 IC50

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 = 50288956   

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 2 receptor (Homo sapiens (Human))	BDBM50288956 (CHEMBL348599 | N-[2-(3,4-Dichloro-phenyl)-4-(4-hyd...) Show SMILES Show InChI InChI=1S/C31H31Cl2F3N4O2/c1-39(28(41)22-6-5-9-25(18-22)30(37-38-30)31(34,35)36)20-23(21-10-11-26(32)27(33)19-21)12-15-40-16-13-29(42,14-17-40)24-7-3-2-4-8-24/h2-11,18-19,23,42H,12-17,20H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	6.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity was determined against human NK2 receptor in CHO cells using [125I]-neurokinin A as radioligand				Bioorg Med Chem Lett 6: 605-608 (1996) Article DOI: 10.1016/0960-894X(96)00075-3 BindingDB Entry DOI: 10.7270/Q2B27V80
					More data for this Ligand-Target Pair