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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 = 'BDBM50300359'   
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


(Homo sapiens (Human))		BDBM50300359
PNG
((S)-2-((S)-1-((2S,8S,11R,14S)-14-amino-8-benzyl-11...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCCN(N=C=S)N=C=S)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)=O |r|
Show InChI InChI=1S/C45H54N10O11S2/c46-33(21-29-11-15-31(57)16-12-29)40(60)51-34(9-4-5-20-55(48-26-67)49-27-68)42(62)52-35(22-28-7-2-1-3-8-28)41(61)47-24-39(59)50-36(23-30-13-17-32(58)18-14-30)44(64)54-19-6-10-38(54)43(63)53-37(25-56)45(65)66/h1-3,7-8,11-18,33-38,56-58H,4-6,9-10,19-25,46H2,(H,47,61)(H,50,59)(H,51,60)(H,52,62)(H,53,63)(H,65,66)/t33-,34+,35-,36-,37-,38-/m0/s1
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Similars
Article
PubMed
n/an/a 97n/an/an/an/an/an/a



The University of Kansas

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor expressed in CHO cells after 90 mins by scintillation counting

J Med Chem 52: 7372-5 (2009)


Article DOI: 10.1021/jm9007592
BindingDB Entry DOI: 10.7270/Q2K64J5B
More data for this
Ligand-Target Pair