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SMILES: FC(F)(F)c1cc(CCCNC(=O)C(c2ccccc2)c2ccccc2)cc(c1)C(F)(F)F

InChI Key: InChIKey=QTRCZKVGWHJYRF-UHFFFAOYSA-N

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50287342   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Substance-P receptor


(Homo sapiens (Human))		BDBM50287342
PNG
(CHEMBL417881 | N-[3-(3,5-Bis-trifluoromethyl-pheny...)
Show SMILES FC(F)(F)c1cc(CCCNC(=O)C(c2ccccc2)c2ccccc2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C25H21F6NO/c26-24(27,28)20-14-17(15-21(16-20)25(29,30)31)8-7-13-32-23(33)22(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,14-16,22H,7-8,13H2,(H,32,33)
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Similars
Article
n/an/a 593n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Affinity for human NK1 receptor determined by displacement of [125I]- Substance P from human NK1 receptor in CHO cells

Bioorg Med Chem Lett 6: 1585-1588 (1996)


Article DOI: 10.1016/S0960-894X(96)00280-6
BindingDB Entry DOI: 10.7270/Q24X57RT
More data for this
Ligand-Target Pair