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Compile Data Set for Download or QSAR

Found 145 hits with Last Name = 'botros' and Initial = 's'   
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
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50225707
PNG
(CHEBI:28973 | Strychnine)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |c:5|
Show InChI InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1
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5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]strychnine from human glycine receptor subunit alpha-1 expressed in HEK293 cell membranes preincubated for 30 mins followed by [3...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570357
PNG
(CHEMBL4865147)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:89|
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81n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]strychnine from human glycine receptor subunit alpha-1 expressed in HEK293 cell membranes preincubated for 30 mins followed by [3...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570358
PNG
(CHEMBL4855686)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCCCCCCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:101|
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204n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]strychnine from human glycine receptor subunit alpha-1 expressed in HEK293 cell membranes preincubated for 30 mins followed by [3...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570355
PNG
(CHEMBL4873527)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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436n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]strychnine from human glycine receptor subunit alpha-1 expressed in HEK293 cell membranes preincubated for 30 mins followed by [3...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570356
PNG
(CHEMBL4864603)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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977n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]strychnine from human glycine receptor subunit alpha-1 expressed in HEK293 cell membranes preincubated for 30 mins followed by [3...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50225707
PNG
(CHEBI:28973 | Strychnine)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |c:5|
Show InChI InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1
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n/an/a 27n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 assessed as inhibition of glycine-induced current measured at the later state of compou...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Delta-type/Kappa-type/Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50228334
PNG
(CHEMBL2112085)
Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)CCC2NC(=O)COCC(O)=O)ccc3O |THB:10:9:14:4.5.6|
Show InChI InChI=1S/C21H26N2O7/c1-23-7-6-20-17-11-2-3-13(24)18(17)30-19(20)12(4-5-21(20,28)14(23)8-11)22-15(25)9-29-10-16(26)27/h2-3,12,14,19,24,28H,4-10H2,1H3,(H,22,25)(H,26,27)/t12?,14-,19+,20+,21-/m1/s1
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n/an/a 27n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
In vitro inhibition of Escherichia coli dihydrofolate reductase.


J Med Chem 32: 2068-71 (1989)


BindingDB Entry DOI: 10.7270/Q2N30067
More data for this
Ligand-Target Pair
Delta-type/Kappa-type/Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50228330
PNG
(CHEMBL2112087)
Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)CCC2NC(=O)C(N)CC(O)=O)ccc3O |THB:10:9:14:4.5.6|
Show InChI InChI=1S/C21H27N3O6/c1-24-7-6-20-16-10-2-3-13(25)17(16)30-18(20)12(4-5-21(20,29)14(24)8-10)23-19(28)11(22)9-15(26)27/h2-3,11-12,14,18,25,29H,4-9,22H2,1H3,(H,23,28)(H,26,27)/t11?,12?,14-,18+,20+,21-/m1/s1
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n/an/a 31n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
In vitro inhibition of Escherichia coli dihydrofolate reductase.


J Med Chem 32: 2068-71 (1989)


BindingDB Entry DOI: 10.7270/Q2N30067
More data for this
Ligand-Target Pair
Delta-type/Kappa-type/Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50228329
PNG
(CHEMBL2112088)
Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)CCC2NC(=O)\C=C/C(O)=O)ccc3O |THB:10:9:14:4.5.6|
Show InChI InChI=1S/C21H24N2O6/c1-23-9-8-20-17-11-2-3-13(24)18(17)29-19(20)12(22-15(25)4-5-16(26)27)6-7-21(20,28)14(23)10-11/h2-5,12,14,19,24,28H,6-10H2,1H3,(H,22,25)(H,26,27)/b5-4-/t12?,14-,19+,20+,21-/m1/s1
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n/an/a 39n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
In vitro inhibition of dihydrofolate reductase enzymes in rat liver


J Med Chem 32: 2068-71 (1989)


BindingDB Entry DOI: 10.7270/Q2N30067
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50225707
PNG
(CHEBI:28973 | Strychnine)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |c:5|
Show InChI InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1
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n/an/a 50n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in HEK293 cells assessed as reduction in glycine-induced currents by whole-ce...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570357
PNG
(CHEMBL4865147)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:89|
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n/an/a 55n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 assessed as inhibition of glycine-induced current measured at the later state of compou...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50225707
PNG
(CHEBI:28973 | Strychnine)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |c:5|
Show InChI InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in HEK293 cells assessed as reduction in glycine-induced currents by whol...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570358
PNG
(CHEMBL4855686)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCCCCCCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:101|
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n/an/a 67n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 assessed as inhibition of glycine-induced current measured at the later state of compou...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570341
PNG
(CHEMBL4849489)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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n/an/a 90n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in HEK293 cells assessed as reduction in glycine-induced currents by whole-ce...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570346
PNG
(CHEMBL4870499)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCCCCCC(=O)NCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:55|
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n/an/a 100n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in HEK293 cells assessed as reduction in glycine-induced currents by whole-ce...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Delta-type/Kappa-type/Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50228331
PNG
(CHEMBL2112083)
Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)CCC2NC(=O)\C=C\C(O)=O)ccc3O |THB:10:9:14:4.5.6|
Show InChI InChI=1S/C21H24N2O6/c1-23-9-8-20-17-11-2-3-13(24)18(17)29-19(20)12(22-15(25)4-5-16(26)27)6-7-21(20,28)14(23)10-11/h2-5,12,14,19,24,28H,6-10H2,1H3,(H,22,25)(H,26,27)/b5-4+/t12?,14-,19+,20+,21-/m1/s1
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n/an/a 130n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
In vitro inhibition of rat liver dihydrofolate reductase.


J Med Chem 32: 2068-71 (1989)


BindingDB Entry DOI: 10.7270/Q2N30067
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570342
PNG
(CHEMBL4857611)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCC(=O)NCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:50|
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n/an/a 130n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in HEK293 cells assessed as reduction in glycine-induced currents by whole-ce...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50225707
PNG
(CHEBI:28973 | Strychnine)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |c:5|
Show InChI InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1
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n/an/a 134n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 assessed as inhibition of glycine-induced current measured at the onset of compound app...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570355
PNG
(CHEMBL4873527)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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n/an/a 137n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 assessed as inhibition of glycine-induced current measured at the later state of compou...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Delta-type/Kappa-type/Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50228332
PNG
(CHEMBL2112079)
Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)CCC2NC(=O)CCC(O)=O)ccc3O |THB:10:9:14:4.5.6|
Show InChI InChI=1S/C21H26N2O6/c1-23-9-8-20-17-11-2-3-13(24)18(17)29-19(20)12(22-15(25)4-5-16(26)27)6-7-21(20,28)14(23)10-11/h2-3,12,14,19,24,28H,4-10H2,1H3,(H,22,25)(H,26,27)/t12?,14-,19+,20+,21-/m1/s1
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n/an/a 144n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
In vitro inhibition of dihydrofolate reductase of Escherichia coli


J Med Chem 32: 2068-71 (1989)


BindingDB Entry DOI: 10.7270/Q2N30067
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50225707
PNG
(CHEBI:28973 | Strychnine)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |c:5|
Show InChI InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50225707
PNG
(CHEBI:28973 | Strychnine)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |c:5|
Show InChI InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570356
PNG
(CHEMBL4864603)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 assessed as inhibition of glycine-induced current measured at the later state of compou...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570343
PNG
(CHEMBL4851242)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCC(=O)NCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:51|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in HEK293 cells assessed as reduction in glycine-induced currents by whole-ce...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50570340
PNG
(CHEMBL4865584)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:49|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response i...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50570340
PNG
(CHEMBL4865584)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:49|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response i...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570344
PNG
(CHEMBL4848356)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCCC(=O)NCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:52|
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n/an/a 400n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in HEK293 cells assessed as reduction in glycine-induced currents by whole-ce...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570340
PNG
(CHEMBL4865584)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:49|
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n/an/a 427n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570340
PNG
(CHEMBL4865584)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:49|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50570341
PNG
(CHEMBL4849489)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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n/an/a 510n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response i...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50225707
PNG
(CHEBI:28973 | Strychnine)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |c:5|
Show InChI InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response i...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50570341
PNG
(CHEMBL4849489)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response i...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50225707
PNG
(CHEBI:28973 | Strychnine)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |c:5|
Show InChI InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response i...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50570333
PNG
(CHEMBL4870655)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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n/an/a 676n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response i...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50570333
PNG
(CHEMBL4870655)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response i...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570339
PNG
(CHEMBL4850957)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:47|
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n/an/a 720n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in HEK293 cells assessed as reduction in glycine-induced currents by whole-ce...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570345
PNG
(CHEMBL4870669)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCCCC(=O)NCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:53|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570345
PNG
(CHEMBL4870669)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCCCC(=O)NCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:53|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570341
PNG
(CHEMBL4849489)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570341
PNG
(CHEMBL4849489)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
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TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50570339
PNG
(CHEMBL4850957)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:47|
PDB

UniProtKB/SwissProt

antibodypedia
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UniChem
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n/an/a 800n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in HEK293 cells assessed as reduction in glycine-induced currents by whol...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570355
PNG
(CHEMBL4873527)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 852n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 assessed as inhibition of glycine-induced current measured at the onset of compound app...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50570345
PNG
(CHEMBL4870669)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCCCC(=O)NCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:53|
PDB

UniProtKB/SwissProt

antibodypedia
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UniChem
Article
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n/an/a 871n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response i...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50570345
PNG
(CHEMBL4870669)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CNC(=O)CCCCCCCCC(=O)NCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:53|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
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n/an/a 880n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response i...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570339
PNG
(CHEMBL4850957)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:47|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570339
PNG
(CHEMBL4850957)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:47|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570337
PNG
(CHEMBL4860026)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:43|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in HEK293 cells assessed as reduction in glycine-induced currents by whole-ce...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570333
PNG
(CHEMBL4870655)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
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UniChem
Article
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n/an/a 1.20E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50570333
PNG
(CHEMBL4870655)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
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UniChem
Article
PubMed
n/an/a 1.23E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1 expressed in human tsA201 cells assessed as reduction in glycine-induced response incub...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50570337
PNG
(CHEMBL4860026)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CCCCCCC(=O)Nc8ccc9N%10C(=O)C[C@]%11([H])OCC=C%12CN%13CC[C@@]%14(c9c8)[C@]%13([H])C[C@]%12([H])[C@]%11([H])[C@]%10%14[H])cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5,t:43|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in HEK293 cells assessed as reduction in glycine-induced currents by whol...


Citation and Details

Article DOI: 10.1021/acs.jnatprod.0c01030
BindingDB Entry DOI: 10.7270/Q2HH6PV6
More data for this
Ligand-Target Pair
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