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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50073518'   
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
Delta-type opioid receptor


(MOUSE)		BDBM50073518
PNG
(2-({1-[2-(2-{2-[2-(2-Amino-2-[4-hydroxy-phenyl]-ac...)
Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1OC(C)=O
Show InChI InChI=1S/C48H61N7O17/c1-25(51-43(64)32(49)19-28-10-14-30(58)15-11-28)42(63)53-33(20-27-7-4-3-5-8-27)44(65)50-22-38(60)52-34(21-29-12-16-31(59)17-13-29)46(67)55-18-6-9-36(55)45(66)54-35(23-56)47(68)70-24-37-41(71-26(2)57)39(61)40(62)48(69)72-37/h3-5,7-8,10-17,25,32-37,39-41,48,56,58-59,61-62,69H,6,9,18-24,49H2,1-2H3,(H,50,65)(H,51,64)(H,52,60)(H,53,63)(H,54,66)/t25-,32+,33+,34+,35+,36+,37-,39-,40-,41-,48+/m1/s1
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Similars
Article
PubMed
 1.32E+3n/an/an/an/an/an/an/an/a



University "La Sapienza" of Rome

Curated by ChEMBL


Assay Description
Displacement of [3H]-NLT from Opioid receptor delta 1 of adult male mouse brain.

J Med Chem 42: 400-4 (1999)


Article DOI: 10.1021/jm9810699
BindingDB Entry DOI: 10.7270/Q2KD1X2G
More data for this
Ligand-Target Pair