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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 = 'BDBM50002455'   
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


(Rattus norvegicus (rat))		BDBM50002455
PNG
(10-Ethyl-1-[2-(1,3,3-trimethyl-1,3-dihydro-indol-2...)
Show SMILES CCn1c2C(CC[n+]2c2cc3ccccc3cc12)=C\C=C1/N(C)c2ccccc2C1(C)C
Show InChI InChI=1S/C29H30N3/c1-5-31-25-18-21-10-6-7-11-22(21)19-26(25)32-17-16-20(28(31)32)14-15-27-29(2,3)23-12-8-9-13-24(23)30(27)4/h6-15,18-19H,5,16-17H2,1-4H3/q+1
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Similars
PubMed
n/an/a 790n/an/an/an/an/an/a



Rochester

Curated by ChEMBL


Assay Description
Inhibition of Tachykinin receptor 1 of rat forebrain tissue

J Med Chem 35: 1273-9 (1992)


BindingDB Entry DOI: 10.7270/Q2222SQM
More data for this
Ligand-Target Pair