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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Substance-P receptor' and Ligand = 'BDBM50120170'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Substance-P receptor


(Homo sapiens (Human))		BDBM50120170
PNG
(2-(1-Benzyl-piperidin-4-ylamino)-1-{4-[2-(3,5-bis-...)
Show SMILES FC(F)(F)c1cc(CC(=O)N2CCN(C(C2)c2ccccc2)C(=O)CNC2CCN(Cc3ccccc3)CC2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C34H36F6N4O2/c35-33(36,37)27-17-25(18-28(20-27)34(38,39)40)19-31(45)43-15-16-44(30(23-43)26-9-5-2-6-10-26)32(46)21-41-29-11-13-42(14-12-29)22-24-7-3-1-4-8-24/h1-10,17-18,20,29-30,41H,11-16,19,21-23H2
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MMDB

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 136n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity in membrane preparations containing recombinant human Tachykinin receptor 1 in CHO cells by using [3H]-Sar SP as the radioligand.

Bioorg Med Chem Lett 12: 3161-5 (2002)


BindingDB Entry DOI: 10.7270/Q2HQ3Z7C
More data for this
Ligand-Target Pair