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SMILES: FC(F)(F)c1cc(CN2C(=O)CC(Cc3c[nH]c4ccccc34)C2=O)cc(c1)C(F)(F)F

InChI Key: InChIKey=UCCMAXPLSJKRBQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50033811   
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))		BDBM50033811
PNG
(1-(3,5-Bis-trifluoromethyl-benzyl)-3-(1H-indol-3-y...)
Show SMILES FC(F)(F)c1cc(CN2C(=O)CC(Cc3c[nH]c4ccccc34)C2=O)cc(c1)C(F)(F)F
Show InChI InChI=1S/C22H16F6N2O2/c23-21(24,25)15-5-12(6-16(9-15)22(26,27)28)11-30-19(31)8-13(20(30)32)7-14-10-29-18-4-2-1-3-17(14)18/h1-6,9-10,13,29H,7-8,11H2
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n/an/a 203n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity at human Tachykinin receptor 1 expressed in CHO cells by [125 I]Trp8-substance P displacement.

J Med Chem 38: 923-33 (1995)


BindingDB Entry DOI: 10.7270/Q25D8SG4
More data for this
Ligand-Target Pair