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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 = 'BDBM102400'   
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


(Rattus norvegicus (rat))
BDBM102400
PNG
(US8536192, I-92)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)C(=O)C(C[C@@]35O)C(=O)Nc1cccnc1 |r,TLB:22:23:18.4.5:7.13.12,THB:24:23:18.4.5:7.13.12|
Show InChI InChI=1S/C26H27N3O5/c30-18-6-5-15-10-19-26(33)11-17(24(32)28-16-2-1-8-27-12-16)21(31)23-25(26,20(15)22(18)34-23)7-9-29(19)13-14-3-4-14/h1-2,5-6,8,12,14,17,19,23,30,33H,3-4,7,9-11,13H2,(H,28,32)/t17?,19-,23+,25+,26-/m1/s1
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PC cid
PC sid
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Similars

US Patent
5.23 -47.3n/an/an/an/an/an/a25



Shionogi & Co. Ltd.

US Patent


Assay Description
Binding assay of opioid receptor.


US Patent US8536192 (2013)


BindingDB Entry DOI: 10.7270/Q24M935Z
More data for this
Ligand-Target Pair