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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neurotensin receptor type 1' and Ligand = 'BDBM50366298'   
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
Neurotensin receptor type 1


(Rattus norvegicus)		BDBM50366298
PNG
(CHEMBL1790466)
Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)c1cccnc1)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C38H55N7O8/c1-5-24(4)32(36(50)43-30(38(52)53)20-23(2)3)44-34(48)29(21-25-13-15-27(46)16-14-25)42-35(49)31-12-9-19-45(31)37(51)28(11-6-7-17-39)41-33(47)26-10-8-18-40-22-26/h8,10,13-16,18,22-24,28-32,46H,5-7,9,11-12,17,19-21,39H2,1-4H3,(H,41,47)(H,42,49)(H,43,50)(H,44,48)(H,52,53)/t24-,28+,29+,30+,31+,32+/m1/s1
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Similars
Article
 420n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against rat neurotensin receptor.

Bioorg Med Chem Lett 3: 2055-2060 (1993)


Article DOI: 10.1016/S0960-894X(01)81014-3
BindingDB Entry DOI: 10.7270/Q2M045XW
More data for this
Ligand-Target Pair