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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50166217'   
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))
BDBM50166217
PNG
(17-(2,6-dichlorobenzyloxy)-10-hydroxy-4-methyl-(13...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(CC1[C@@]3(CCC4=O)OCc1c(Cl)cccc1Cl)ccc5O |TLB:7:8:12:1.3.2,27:9:12:1.3.2|
Show InChI InChI=1S/C24H23Cl2NO4/c1-27-10-9-23-20-13-5-6-17(28)21(20)31-22(23)18(29)7-8-24(23,19(27)11-13)30-12-14-15(25)3-2-4-16(14)26/h2-6,19,22,28H,7-12H2,1H3/t19?,22-,23-,24+/m0/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
152n/an/an/an/an/an/an/an/a



University La Sapienza

Curated by ChEMBL


Assay Description
Inhibition of [3H][Ile5,6]deltorphin II binding to opioid receptor delta from rat brain membranes


J Med Chem 48: 3372-8 (2005)


Article DOI: 10.1021/jm040894o
BindingDB Entry DOI: 10.7270/Q2X92C3R
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50166217
PNG
(17-(2,6-dichlorobenzyloxy)-10-hydroxy-4-methyl-(13...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(CC1[C@@]3(CCC4=O)OCc1c(Cl)cccc1Cl)ccc5O |TLB:7:8:12:1.3.2,27:9:12:1.3.2|
Show InChI InChI=1S/C24H23Cl2NO4/c1-27-10-9-23-20-13-5-6-17(28)21(20)31-22(23)18(29)7-8-24(23,19(27)11-13)30-12-14-15(25)3-2-4-16(14)26/h2-6,19,22,28H,7-12H2,1H3/t19?,22-,23-,24+/m0/s1
PDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 209n/an/an/an/an/an/a



University La Sapienza

Curated by ChEMBL


Assay Description
In vitro agonistic activity against opioid receptor delta of mouse vas deferens


J Med Chem 48: 3372-8 (2005)


Article DOI: 10.1021/jm040894o
BindingDB Entry DOI: 10.7270/Q2X92C3R
More data for this
Ligand-Target Pair