BDBM50410784 CHEMBL264660

SMILES: CN(C)CCO\N=C(\C)CN1CCN([C@H](Cc2c[nH]c3ccccc23)C1)C(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F

InChI Key: InChIKey=FCHBLJWTDQDKLL-PBHFAPSUSA-N

Data: 1 Kd

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 = 50410784   

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))	BDBM50410784 (CHEMBL264660) Show SMILES CN(C)CCO\N=C(\C)CN1CCN([C@H](Cc2c[nH]c3ccccc23)C1)C(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C29H33F6N5O2/c1-19(37-42-11-10-38(2)3)17-39-8-9-40(24(18-39)14-21-16-36-26-7-5-4-6-25(21)26)27(41)20-12-22(28(30,31)32)15-23(13-20)29(33,34)35/h4-7,12-13,15-16,24,36H,8-11,14,17-18H2,1-3H3/b37-19-/t24-/m1/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	n/a	7.94	n/a	n/a	n/a	n/a	n/a
Solvay Pharma Curated by ChEMBL					Assay Description Effect on IP3 turnover by phospholipaseC positively linked to human NK1 receptor expressed in CHO cells				Bioorg Med Chem Lett 16: 1045-8 (2006) Article DOI: 10.1016/j.bmcl.2005.10.077 BindingDB Entry DOI: 10.7270/Q2XD12W0
					More data for this Ligand-Target Pair