BDBM50308395 (S)-2-amino-N-((S)-1-amino-3-(3-fluorophenyl)-1-oxopropan-2-yl)-3-cyclohexylpropanamide::CHEMBL589544

SMILES: N[C@@H](CC1CCCCC1)C(=O)N[C@@H](Cc1cccc(F)c1)C(N)=O

InChI Key: InChIKey=SNWPJCBIQYXAKG-HOTGVXAUSA-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 = 50308395   

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 (Rattus norvegicus (rat))	BDBM50308395 ((S)-2-amino-N-((S)-1-amino-3-(3-fluorophenyl)-1-ox...) Show SMILES N[C@@H](CC1CCCCC1)C(=O)N[C@@H](Cc1cccc(F)c1)C(N)=O |r| Show InChI InChI=1S/C18H26FN3O2/c19-14-8-4-7-13(9-14)11-16(17(21)23)22-18(24)15(20)10-12-5-2-1-3-6-12/h4,7-9,12,15-16H,1-3,5-6,10-11,20H2,(H2,21,23)(H,22,24)/t15-,16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	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 in Sprague-Dawley rat spinal cord membrane				J Med Chem 53: 2383-9 (2010) Article DOI: 10.1021/jm901352b BindingDB Entry DOI: 10.7270/Q2542NQK
					More data for this Ligand-Target Pair