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Compile Data Set for Download or QSAR

Found 110 hits Enz. Inhib. hit(s) with all data for entry = 50011558   
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
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548585
PNG
(CHEMBL4748898)
Show SMILES CC1OC2(CCN(CCc3ccccc3)CC2)CN(Cc2ccccc2)C1=O
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2n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50514234
PNG
(CHEMBL4541206)
Show SMILES CC1OC2(CCN(CCc3ccccc3)CC2)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C23H28N2O2/c1-19-22(26)25(21-10-6-3-7-11-21)18-23(27-19)13-16-24(17-14-23)15-12-20-8-4-2-5-9-20/h2-11,19H,12-18H2,1H3
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6n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548583
PNG
(CHEMBL4789005)
Show SMILES C[C@H]1OC2(CCN(CCc3ccccc3)CC2)CN(C2CC2)C1=O |r|
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6n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50514234
PNG
(CHEMBL4541206)
Show SMILES CC1OC2(CCN(CCc3ccccc3)CC2)CN(C1=O)c1ccccc1
Show InChI InChI=1S/C23H28N2O2/c1-19-22(26)25(21-10-6-3-7-11-21)18-23(27-19)13-16-24(17-14-23)15-12-20-8-4-2-5-9-20/h2-11,19H,12-18H2,1H3
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7n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548585
PNG
(CHEMBL4748898)
Show SMILES CC1OC2(CCN(CCc3ccccc3)CC2)CN(Cc2ccccc2)C1=O
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10n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50370595
PNG
(OXYCODONE | Oxycontin | US1184575, oxycodone | US9...)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O |TLB:20:21:16.5.6:8.11.10,THB:22:21:16.5.6:8.11.10|
Show InChI InChI=1S/C18H21NO4/c1-19-8-7-17-14-10-3-4-12(22-2)15(14)23-16(17)11(20)5-6-18(17,21)13(19)9-10/h3-4,13,16,21H,5-9H2,1-2H3/t13-,16+,17+,18-/m1/s1
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12n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548584
PNG
(CHEMBL4796605)
Show SMILES CC1OC2(CCN(CCc3ccccc3)CC2)CN(CCc2ccccc2)C1=O
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12n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50396352
PNG
(CHEMBL2170062)
Show SMILES Cc1cc(OCCN2CCOCC2)nn1-c1ccc2ccccc2c1
Show InChI InChI=1S/C20H23N3O2/c1-16-14-20(25-13-10-22-8-11-24-12-9-22)21-23(16)19-7-6-17-4-2-3-5-18(17)15-19/h2-7,14-15H,8-13H2,1H3
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17n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548573
PNG
(CHEMBL4776924)
Show SMILES CCN1CC2(CCN(CCc3ccccc3F)CC2)O[C@H](C)C1=O |r|
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18n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548584
PNG
(CHEMBL4796605)
Show SMILES CC1OC2(CCN(CCc3ccccc3)CC2)CN(CCc2ccccc2)C1=O
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20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548587
PNG
(CHEMBL4756310)
Show SMILES CCN1CC2(CCN(CCc3c(F)cccc3F)CC2)O[C@H](C)C1=O |r|
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21n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548570
PNG
(CHEMBL4776743)
Show SMILES CCN1CC2(CCN(CCc3cccc(F)c3F)CC2)O[C@H](C)C1=O |r|
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22n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548574
PNG
(CHEMBL4741494)
Show SMILES CCN1CC2(CCN(CCc3ccccc3)CC2)O[C@H](C)C1=O |r|
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26n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548582
PNG
(CHEMBL4759184)
Show SMILES CC(C)N1CC2(CCN(CCc3ccccc3)CC2)OC(C)C1=O
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30n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548582
PNG
(CHEMBL4759184)
Show SMILES CC(C)N1CC2(CCN(CCc3ccccc3)CC2)OC(C)C1=O
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33n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548581
PNG
(CHEMBL4755446)
Show SMILES CCN1CC2(CCN(CCc3ccccc3)CC2)OC(C)C1=O
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41n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548581
PNG
(CHEMBL4755446)
Show SMILES CCN1CC2(CCN(CCc3ccccc3)CC2)OC(C)C1=O
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43n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548588
PNG
(CHEMBL4751130)
Show SMILES CN1CC2(CCN(CCc3ccccc3)CC2)OC(C)(C)C1=O
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50n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548572
PNG
(CHEMBL4754130)
Show SMILES CCN1CC2(CCN(CCc3cccc(F)c3)CC2)O[C@H](C)C1=O |r|
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56n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50514245
PNG
(CHEMBL4461774)
Show SMILES Fc1ccccc1CCN1CCC2(CC1)CN(C(=O)C1(CC1)O2)c1cccnc1C(F)(F)F
Show InChI InChI=1S/C24H25F4N3O2/c25-18-5-2-1-4-17(18)7-13-30-14-10-22(11-15-30)16-31(21(32)23(33-22)8-9-23)19-6-3-12-29-20(19)24(26,27)28/h1-6,12H,7-11,13-16H2
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58n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548583
PNG
(CHEMBL4789005)
Show SMILES C[C@H]1OC2(CCN(CCc3ccccc3)CC2)CN(C2CC2)C1=O |r|
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58n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548569
PNG
(CHEMBL4777859)
Show SMILES CCN1CC2(CCN(CCc3ccc(F)cc3F)CC2)O[C@H](C)C1=O |r|
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62n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548568
PNG
(CHEMBL4781352)
Show SMILES CCN1CC2(CCN(CCc3cc(F)ccc3F)CC2)O[C@H](C)C1=O |r|
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64n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548572
PNG
(CHEMBL4754130)
Show SMILES CCN1CC2(CCN(CCc3cccc(F)c3)CC2)O[C@H](C)C1=O |r|
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64n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548574
PNG
(CHEMBL4741494)
Show SMILES CCN1CC2(CCN(CCc3ccccc3)CC2)O[C@H](C)C1=O |r|
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66n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548573
PNG
(CHEMBL4776924)
Show SMILES CCN1CC2(CCN(CCc3ccccc3F)CC2)O[C@H](C)C1=O |r|
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68n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548571
PNG
(CHEMBL4788650)
Show SMILES CCN1CC2(CCN(CCc3ccc(F)cc3)CC2)O[C@H](C)C1=O |r|
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76n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548578
PNG
(CHEMBL4753006)
Show SMILES C[C@H]1OC2(CCN(CCc3ccccc3)CC2)CN(C)C1=O |r|
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91n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548569
PNG
(CHEMBL4777859)
Show SMILES CCN1CC2(CCN(CCc3ccc(F)cc3F)CC2)O[C@H](C)C1=O |r|
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94n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548576
PNG
(CHEMBL4755342)
Show SMILES CC(C)C1OC2(CCN(CCc3ccccc3)CC2)CN(C)C1=O
PDB

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115n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548568
PNG
(CHEMBL4781352)
Show SMILES CCN1CC2(CCN(CCc3cc(F)ccc3F)CC2)O[C@H](C)C1=O |r|
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118n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548576
PNG
(CHEMBL4755342)
Show SMILES CC(C)C1OC2(CCN(CCc3ccccc3)CC2)CN(C)C1=O
PDB

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122n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548567
PNG
(CHEMBL4761093)
Show SMILES CCN1CC2(CCN(CCc3cc(F)ccc3F)CC2)O[C@@H](C)C1=O |r|
PDB

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135n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548577
PNG
(CHEMBL4752386)
Show SMILES CC[C@H]1OC2(CCN(CCc3ccccc3)CC2)CN(C)C1=O |r|
PDB

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139n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548580
PNG
(CHEMBL4786209)
Show SMILES CC1OC2(CCN(CCc3ccccc3)CC2)CN(C)C1=O
PDB

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142n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548580
PNG
(CHEMBL4786209)
Show SMILES CC1OC2(CCN(CCc3ccccc3)CC2)CN(C)C1=O
PDB

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156n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548575
PNG
(CHEMBL4762816)
Show SMILES CN1CC2(CCN(CCc3ccccc3)CC2)OC2(CC2)C1=O
PDB

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161n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548571
PNG
(CHEMBL4788650)
Show SMILES CCN1CC2(CCN(CCc3ccc(F)cc3)CC2)O[C@H](C)C1=O |r|
PDB

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164n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548591
PNG
(CHEMBL4761794)
Show SMILES C[C@@H]1OC2(CCN(CCc3ccccc3)CC2)CN(C)C1=O |r|
PDB

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165n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50514245
PNG
(CHEMBL4461774)
Show SMILES Fc1ccccc1CCN1CCC2(CC1)CN(C(=O)C1(CC1)O2)c1cccnc1C(F)(F)F
Show InChI InChI=1S/C24H25F4N3O2/c25-18-5-2-1-4-17(18)7-13-30-14-10-22(11-15-30)16-31(21(32)23(33-22)8-9-23)19-6-3-12-29-20(19)24(26,27)28/h1-6,12H,7-11,13-16H2
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175n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548577
PNG
(CHEMBL4752386)
Show SMILES CC[C@H]1OC2(CCN(CCc3ccccc3)CC2)CN(C)C1=O |r|
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192n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548575
PNG
(CHEMBL4762816)
Show SMILES CN1CC2(CCN(CCc3ccccc3)CC2)OC2(CC2)C1=O
PDB

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221n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548589
PNG
(CHEMBL4796930)
Show SMILES CN1CC2(CCN(CCc3ccccc3)CC2)OC(C1=O)c1ccccc1
PDB

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242n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548578
PNG
(CHEMBL4753006)
Show SMILES C[C@H]1OC2(CCN(CCc3ccccc3)CC2)CN(C)C1=O |r|
PDB

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277n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548590
PNG
(CHEMBL4754601)
Show SMILES CN1CC2(CCN(CCc3ccccc3)CC2)OCC1=O
PDB

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282n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548570
PNG
(CHEMBL4776743)
Show SMILES CCN1CC2(CCN(CCc3cccc(F)c3F)CC2)O[C@H](C)C1=O |r|
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556n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548587
PNG
(CHEMBL4756310)
Show SMILES CCN1CC2(CCN(CCc3c(F)cccc3F)CC2)O[C@H](C)C1=O |r|
PDB

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609n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548586
PNG
(CHEMBL4750243)
Show SMILES CCN1CC2(CCN(CCc3ccccn3)CC2)OC2(CC2)C1=O
PDB

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783n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50548579
PNG
(CHEMBL4787186)
Show SMILES CC1OC2(CCN(CCc3ccccc3)CC2)CN(CCc2ccccc2F)C1=O
PDB

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892n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of 3H](+)-pentazocine from human sigma1 receptor expressed in HEK293 cell membranes incubated for 120 mins by liquid scintillation count...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50548579
PNG
(CHEMBL4787186)
Show SMILES CC1OC2(CCN(CCc3ccccc3)CC2)CN(CCc2ccccc2F)C1=O
PDB

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>1.00E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-DAMGO from human MOR expressed in CHOK1 cell membranes incubated for 60 mins by liquid scintillation counting method


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01127
BindingDB Entry DOI: 10.7270/Q2PC35ZC
More data for this
Ligand-Target Pair
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