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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 = 'BDBM50366307'   
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)		BDBM50366307
PNG
(CHEMBL1790457)
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)CCCCC1SCC2NC(=O)NC12)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C42H66N8O9S/c1-5-25(4)35(39(55)46-30(41(57)58)21-24(2)3)48-37(53)29(22-26-15-17-27(51)18-16-26)45-38(54)32-12-10-20-50(32)40(56)28(11-8-9-19-43)44-34(52)14-7-6-13-33-36-31(23-60-33)47-42(59)49-36/h15-18,24-25,28-33,35-36,51H,5-14,19-23,43H2,1-4H3,(H,44,52)(H,45,54)(H,46,55)(H,48,53)(H,57,58)(H2,47,49,59)/t25-,28+,29+,30+,31?,32+,33?,35+,36?/m1/s1
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Similars
Article
 290n/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