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Compile Data Set for Download or QSAR

Found 251 hits with Last Name = 'breitinger' and Initial = 'u'   
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


(RAT)
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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12n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from glycine receptor alpha 1 in rat brain synaptic membranes


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(RAT)
BDBM50232884
PNG
(CHEMBL4060962)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(N)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H23N3O2/c22-12-1-2-15-14(7-12)21-4-5-23-10-11-3-6-26-16-9-18(25)24(15)20(21)19(16)13(11)8-17(21)23/h1-3,7,13,16-17,19-20H,4-6,8-10,22H2/t13-,16-,17-,19-,20-,21+/m0/s1
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18n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from glycine receptor alpha 1 in rat brain synaptic membranes


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
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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23n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from recombinant human glycine receptor alpha 1 expressed in HEK293 cell membranes after 30 mins by liquid scintillati...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232885
PNG
(CHEMBL4089150)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/O)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H21N3O3/c25-20-17(22-26)18-16-12-9-15-21(6-7-23(15)10-11(12)5-8-27-18)13-3-1-2-4-14(13)24(20)19(16)21/h1-5,12,15-16,18-19,26H,6-10H2/b22-17+/t12-,15-,16-,18+,19-,21+/m0/s1
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40n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from recombinant human glycine receptor alpha 1 expressed in HEK293 cell membranes after 30 mins by liquid scintillati...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232888
PNG
(CHEMBL4096857)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(NC(=O)CC)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H27N3O3/c1-2-20(28)25-14-3-4-17-16(9-14)24-6-7-26-12-13-5-8-30-18-11-21(29)27(17)23(24)22(18)15(13)10-19(24)26/h3-5,9,15,18-19,22-23H,2,6-8,10-12H2,1H3,(H,25,28)/t15-,18-,19-,22-,23-,24+/m0/s1
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67n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from recombinant human glycine receptor alpha 1 expressed in HEK293 cell membranes after 30 mins by liquid scintillati...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
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))
BDBM50510757
PNG
(CHEMBL4518537)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])[C@H](NC(=O)CC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H27N3O3/c1-2-18(28)25-20-21-19-14-11-17-24(8-9-26(17)12-13(14)7-10-30-21)15-5-3-4-6-16(15)27(22(19)24)23(20)29/h3-7,14,17,19-22H,2,8-12H2,1H3,(H,25,28)/t14-,17-,19-,20-,21+,22-,24+/m0/s1
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91n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from human glycine receptor subunit alpha-1 expressed in HEK293 cell membranes


J Nat Prod 82: 2332-2336 (2019)


Article DOI: 10.1021/acs.jnatprod.9b00180
BindingDB Entry DOI: 10.7270/Q2571GB7
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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123n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from human glycine receptor subunit alpha-1 expressed in HEK293 cell membranes


J Nat Prod 82: 2332-2336 (2019)


Article DOI: 10.1021/acs.jnatprod.9b00180
BindingDB Entry DOI: 10.7270/Q2571GB7
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232890
PNG
(CHEMBL4102677)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C22H23N3O3/c1-27-23-18-19-17-13-10-16-22(7-8-24(16)11-12(13)6-9-28-19)14-4-2-3-5-15(14)25(20(17)22)21(18)26/h2-6,13,16-17,19-20H,7-11H2,1H3/b23-18+/t13-,16-,17-,19+,20-,22+/m0/s1
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189n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from recombinant human glycine receptor alpha 1 expressed in HEK293 cell membranes after 30 mins by liquid scintillati...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
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))
BDBM50232897
PNG
(CHEMBL4068867)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCCC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H27N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h3-7,15,18-19,21-22H,2,8-13H2,1H3/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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241n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from recombinant human glycine receptor alpha 1 expressed in HEK293 cell membranes after 30 mins by liquid scintillati...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232896
PNG
(CHEMBL4079657)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC=C)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H25N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h2-7,15,18-19,21-22H,1,8-13H2/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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370n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from recombinant human glycine receptor alpha 1 expressed in HEK293 cell membranes after 30 mins by liquid scintillati...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
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))
BDBM50510756
PNG
(CHEMBL4447664)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])[C@H](N)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H23N3O2/c22-17-18-16-12-9-15-21(6-7-23(15)10-11(12)5-8-26-18)13-3-1-2-4-14(13)24(19(16)21)20(17)25/h1-5,12,15-19H,6-10,22H2/t12-,15-,16-,17-,18+,19-,21+/m0/s1
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741n/an/an/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]strychnine from human glycine receptor subunit alpha-1 expressed in HEK293 cell membranes


J Nat Prod 82: 2332-2336 (2019)


Article DOI: 10.1021/acs.jnatprod.9b00180
BindingDB Entry DOI: 10.7270/Q2571GB7
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)
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50232889
PNG
(CHEMBL4103909)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC#C)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H23N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h1,3-7,15,18-19,21-22H,8-13H2/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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n/an/a 43n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 beta expressed in HEK293 cells assessed as inhibition of glycine-induced current at...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50232896
PNG
(CHEMBL4079657)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC=C)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H25N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h2-7,15,18-19,21-22H,1,8-13H2/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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n/an/a 46n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 beta expressed in HEK293 cells assessed as inhibition of glycine-induced current at...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232896
PNG
(CHEMBL4079657)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC=C)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H25N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h2-7,15,18-19,21-22H,1,8-13H2/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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n/an/a 49n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in HEK293 cells assessed as inhibition of glycine-induced current at -50 ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
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 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))
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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The German University in Cairo

Curated by ChEMBL


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


J Nat Prod 82: 2332-2336 (2019)


Article DOI: 10.1021/acs.jnatprod.9b00180
BindingDB Entry DOI: 10.7270/Q2571GB7
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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n/an/a 51n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in HEK293 cells assessed as inhibition of glycine-induced current at -50 ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232889
PNG
(CHEMBL4103909)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC#C)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H23N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h1,3-7,15,18-19,21-22H,8-13H2/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232889
PNG
(CHEMBL4103909)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC#C)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H23N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h1,3-7,15,18-19,21-22H,8-13H2/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
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))
BDBM50232890
PNG
(CHEMBL4102677)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C22H23N3O3/c1-27-23-18-19-17-13-10-16-22(7-8-24(16)11-12(13)6-9-28-19)14-4-2-3-5-15(14)25(20(17)22)21(18)26/h2-6,13,16-17,19-20H,7-11H2,1H3/b23-18+/t13-,16-,17-,19+,20-,22+/m0/s1
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n/an/a 56n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 beta expressed in HEK293 cells assessed as inhibition of glycine-induced current at...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
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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n/an/a 58n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at human glycine receptor subunit alpha-1beta expressed in HEK293 cells assessed as reduction in glycine-induced whole cell curre...


J Nat Prod 82: 2332-2336 (2019)


Article DOI: 10.1021/acs.jnatprod.9b00180
BindingDB Entry DOI: 10.7270/Q2571GB7
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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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n/an/a 58n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 beta expressed in HEK293 cells assessed as inhibition of glycine-induced current at...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232889
PNG
(CHEMBL4103909)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC#C)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H23N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h1,3-7,15,18-19,21-22H,8-13H2/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in HEK293 cells assessed as inhibition of glycine-induced current at -50 ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
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))
BDBM50232890
PNG
(CHEMBL4102677)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C22H23N3O3/c1-27-23-18-19-17-13-10-16-22(7-8-24(16)11-12(13)6-9-28-19)14-4-2-3-5-15(14)25(20(17)22)21(18)26/h2-6,13,16-17,19-20H,7-11H2,1H3/b23-18+/t13-,16-,17-,19+,20-,22+/m0/s1
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n/an/a 75n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in HEK293 cells assessed as inhibition of glycine-induced current at -50 ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232884
PNG
(CHEMBL4060962)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(N)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H23N3O2/c22-12-1-2-15-14(7-12)21-4-5-23-10-11-3-6-26-16-9-18(25)24(15)20(21)19(16)13(11)8-17(21)23/h1-3,7,13,16-17,19-20H,4-6,8-10,22H2/t13-,16-,17-,19-,20-,21+/m0/s1
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n/an/a 76n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in HEK293 cells assessed as inhibition of glycine-induced current at -50 ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232884
PNG
(CHEMBL4060962)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(N)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H23N3O2/c22-12-1-2-15-14(7-12)21-4-5-23-10-11-3-6-26-16-9-18(25)24(15)20(21)19(16)13(11)8-17(21)23/h1-3,7,13,16-17,19-20H,4-6,8-10,22H2/t13-,16-,17-,19-,20-,21+/m0/s1
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n/an/a 77n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232884
PNG
(CHEMBL4060962)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(N)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H23N3O2/c22-12-1-2-15-14(7-12)21-4-5-23-10-11-3-6-26-16-9-18(25)24(15)20(21)19(16)13(11)8-17(21)23/h1-3,7,13,16-17,19-20H,4-6,8-10,22H2/t13-,16-,17-,19-,20-,21+/m0/s1
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n/an/a 78n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50232885
PNG
(CHEMBL4089150)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/O)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H21N3O3/c25-20-17(22-26)18-16-12-9-15-21(6-7-23(15)10-11(12)5-8-27-18)13-3-1-2-4-14(13)24(20)19(16)21/h1-5,12,15-16,18-19,26H,6-10H2/b22-17+/t12-,15-,16-,18+,19-,21+/m0/s1
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n/an/a 80n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 beta expressed in HEK293 cells assessed as inhibition of glycine-induced current at...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232885
PNG
(CHEMBL4089150)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/O)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H21N3O3/c25-20-17(22-26)18-16-12-9-15-21(6-7-23(15)10-11(12)5-8-27-18)13-3-1-2-4-14(13)24(20)19(16)21/h1-5,12,15-16,18-19,26H,6-10H2/b22-17+/t12-,15-,16-,18+,19-,21+/m0/s1
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n/an/a 82n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in HEK293 cells assessed as inhibition of glycine-induced current at -50 ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
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))
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 93n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232896
PNG
(CHEMBL4079657)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC=C)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H25N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h2-7,15,18-19,21-22H,1,8-13H2/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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n/an/a 95n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232885
PNG
(CHEMBL4089150)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/O)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H21N3O3/c25-20-17(22-26)18-16-12-9-15-21(6-7-23(15)10-11(12)5-8-27-18)13-3-1-2-4-14(13)24(20)19(16)21/h1-5,12,15-16,18-19,26H,6-10H2/b22-17+/t12-,15-,16-,18+,19-,21+/m0/s1
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n/an/a 97n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1/beta


(Homo sapiens (Human))
BDBM50232884
PNG
(CHEMBL4060962)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6c7ccc(N)cc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H23N3O2/c22-12-1-2-15-14(7-12)21-4-5-23-10-11-3-6-26-16-9-18(25)24(15)20(21)19(16)13(11)8-17(21)23/h1-3,7,13,16-17,19-20H,4-6,8-10,22H2/t13-,16-,17-,19-,20-,21+/m0/s1
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n/an/a 97n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 beta expressed in HEK293 cells assessed as inhibition of glycine-induced current at...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232885
PNG
(CHEMBL4089150)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/O)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C21H21N3O3/c25-20-17(22-26)18-16-12-9-15-21(6-7-23(15)10-11(12)5-8-27-18)13-3-1-2-4-14(13)24(20)19(16)21/h1-5,12,15-16,18-19,26H,6-10H2/b22-17+/t12-,15-,16-,18+,19-,21+/m0/s1
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n/an/a 98n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
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
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232890
PNG
(CHEMBL4102677)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C22H23N3O3/c1-27-23-18-19-17-13-10-16-22(7-8-24(16)11-12(13)6-9-28-19)14-4-2-3-5-15(14)25(20(17)22)21(18)26/h2-6,13,16-17,19-20H,7-11H2,1H3/b23-18+/t13-,16-,17-,19+,20-,22+/m0/s1
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n/an/a 100n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232890
PNG
(CHEMBL4102677)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C22H23N3O3/c1-27-23-18-19-17-13-10-16-22(7-8-24(16)11-12(13)6-9-28-19)14-4-2-3-5-15(14)25(20(17)22)21(18)26/h2-6,13,16-17,19-20H,7-11H2,1H3/b23-18+/t13-,16-,17-,19+,20-,22+/m0/s1
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n/an/a 105n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232897
PNG
(CHEMBL4068867)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCCC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H27N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h3-7,15,18-19,21-22H,2,8-13H2,1H3/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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n/an/a 109n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in HEK293 cells assessed as inhibition of glycine-induced current at -50 ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232897
PNG
(CHEMBL4068867)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCCC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H27N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h3-7,15,18-19,21-22H,2,8-13H2,1H3/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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n/an/a 110n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


(Homo sapiens (Human))
BDBM50232897
PNG
(CHEMBL4068867)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCCC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H27N3O3/c1-2-10-30-25-20-21-19-15-12-18-24(8-9-26(18)13-14(15)7-11-29-21)16-5-3-4-6-17(16)27(22(19)24)23(20)28/h3-7,15,18-19,21-22H,2,8-13H2,1H3/b25-20+/t15-,18-,19-,21+,22-,24+/m0/s1
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n/an/a 115n/an/an/an/an/an/a



The German University in Cairo

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human glycine receptor alpha 1 expressed in human tsA201 cells assessed as inhibition of glycine-induced receptor ...


J Nat Prod 79: 2997-3005 (2016)


Article DOI: 10.1021/acs.jnatprod.6b00479
BindingDB Entry DOI: 10.7270/Q2QZ2D66
More data for this
Ligand-Target Pair
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