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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 = 'BDBM50116720'   
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))		BDBM50116720
PNG
(CHEMBL77042 | [3-(1-{(R)-5-[(3,5-Dichloro-benzoyl)...)
Show SMILES CO\N=C(/CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](CCN1CCC(CC1)n1c2ccccc2n(CC(O)=O)c1=O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C34H35Cl4N5O5/c1-40(33(46)22-15-23(35)18-24(36)16-22)19-29(39-48-2)26(21-7-8-27(37)28(38)17-21)11-14-41-12-9-25(10-13-41)43-31-6-4-3-5-30(31)42(34(43)47)20-32(44)45/h3-8,15-18,25-26H,9-14,19-20H2,1-2H3,(H,44,45)/b39-29+/t26-/m1/s1
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MMDB

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Similars
PubMed
 1.30n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against recombinant human tachykinin receptor 1 in CHO cells using [3H]-Sar SP as radioligand

Bioorg Med Chem Lett 12: 2355-8 (2002)


BindingDB Entry DOI: 10.7270/Q26T0KXW
More data for this
Ligand-Target Pair