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Compile Data Set for Download or QSAR

Found 114 hits Enz. Inhib. hit(s) with Target = 'Glycine receptor subunit alpha-1/beta' AND taxid = 9606   
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/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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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))
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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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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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/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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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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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/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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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))
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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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))
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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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))
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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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
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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The German University in Cairo

Curated by ChEMBL


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


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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The German University in Cairo

Curated by ChEMBL


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


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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The German University in Cairo

Curated by ChEMBL


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


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/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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The German University in Cairo

Curated by ChEMBL


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


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/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/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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The German University in Cairo

Curated by ChEMBL


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


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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The German University in Cairo

Curated by ChEMBL


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


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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The German University in Cairo

Curated by ChEMBL


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


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))
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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The German University in Cairo

Curated by ChEMBL


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


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))
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 240n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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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The German University in Cairo

Curated by ChEMBL


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


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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The German University in Cairo

Curated by ChEMBL


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


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))
BDBM50232891
PNG
(CHEMBL4086212)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCc6ccccc6)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C28H27N3O3/c32-27-24(29-34-16-17-6-2-1-3-7-17)25-23-19-14-22-28(11-12-30(22)15-18(19)10-13-33-25)20-8-4-5-9-21(20)31(27)26(23)28/h1-10,19,22-23,25-26H,11-16H2/b29-24+/t19-,22-,23-,25+,26-,28+/m0/s1
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n/an/a 309n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
BDBM50232891
PNG
(CHEMBL4086212)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCc6ccccc6)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C28H27N3O3/c32-27-24(29-34-16-17-6-2-1-3-7-17)25-23-19-14-22-28(11-12-30(22)15-18(19)10-13-33-25)20-8-4-5-9-21(20)31(27)26(23)28/h1-10,19,22-23,25-26H,11-16H2/b29-24+/t19-,22-,23-,25+,26-,28+/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 beta expressed in human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
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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n/an/a 311n/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))
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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The German University in Cairo

Curated by ChEMBL


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


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))
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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The German University in Cairo

Curated by ChEMBL


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


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))
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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The German University in Cairo

Curated by ChEMBL


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


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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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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n/an/a 513n/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))
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-1beta expressed in human tsA201 cells assessed as reduction in glycine-induced response b...


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))
BDBM50232887
PNG
(CHEMBL4096505)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC(=O)OC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H25N3O5/c1-30-18(28)12-32-25-20-21-19-14-10-17-24(7-8-26(17)11-13(14)6-9-31-21)15-4-2-3-5-16(15)27(22(19)24)23(20)29/h2-6,14,17,19,21-22H,7-12H2,1H3/b25-20+/t14-,17-,19-,21+,22-,24+/m0/s1
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n/an/a 661n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
BDBM50232887
PNG
(CHEMBL4096505)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC(=O)OC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C24H25N3O5/c1-30-18(28)12-32-25-20-21-19-14-10-17-24(7-8-26(17)11-13(14)6-9-31-21)15-4-2-3-5-16(15)27(22(19)24)23(20)29/h2-6,14,17,19,21-22H,7-12H2,1H3/b25-20+/t14-,17-,19-,21+,22-,24+/m0/s1
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n/an/a 670n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
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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n/an/a 680n/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))
BDBM50232895
PNG
(CHEMBL4087535)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCCCCC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C26H31N3O3/c1-2-3-6-12-32-27-22-23-21-17-14-20-26(10-11-28(20)15-16(17)9-13-31-23)18-7-4-5-8-19(18)29(24(21)26)25(22)30/h4-5,7-9,17,20-21,23-24H,2-3,6,10-15H2,1H3/b27-22+/t17-,20-,21-,23+,24-,26+/m0/s1
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n/an/a 708n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
BDBM50232895
PNG
(CHEMBL4087535)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCCCCC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C26H31N3O3/c1-2-3-6-12-32-27-22-23-21-17-14-20-26(10-11-28(20)15-16(17)9-13-31-23)18-7-4-5-8-19(18)29(24(21)26)25(22)30/h4-5,7-9,17,20-21,23-24H,2-3,6,10-15H2,1H3/b27-22+/t17-,20-,21-,23+,24-,26+/m0/s1
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n/an/a 710n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
BDBM50232892
PNG
(CHEMBL4066164)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCCc6ccccc6)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C29H29N3O3/c33-28-25(30-35-15-10-18-6-2-1-3-7-18)26-24-20-16-23-29(12-13-31(23)17-19(20)11-14-34-26)21-8-4-5-9-22(21)32(28)27(24)29/h1-9,11,20,23-24,26-27H,10,12-17H2/b30-25+/t20-,23-,24-,26+,27-,29+/m0/s1
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n/an/a 776n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
BDBM50232892
PNG
(CHEMBL4066164)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCCc6ccccc6)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C29H29N3O3/c33-28-25(30-35-15-10-18-6-2-1-3-7-18)26-24-20-16-23-29(12-13-31(23)17-19(20)11-14-34-26)21-8-4-5-9-22(21)32(28)27(24)29/h1-9,11,20,23-24,26-27H,10,12-17H2/b30-25+/t20-,23-,24-,26+,27-,29+/m0/s1
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n/an/a 780n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
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 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/beta


(Homo sapiens (Human))
BDBM50232883
PNG
(CHEMBL4096154)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCCCC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C25H29N3O3/c1-2-3-11-31-26-21-22-20-16-13-19-25(9-10-27(19)14-15(16)8-12-30-22)17-6-4-5-7-18(17)28(23(20)25)24(21)29/h4-8,16,19-20,22-23H,2-3,9-14H2,1H3/b26-21+/t16-,19-,20-,22+,23-,25+/m0/s1
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n/an/a 871n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
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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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))
BDBM50232883
PNG
(CHEMBL4096154)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCCCC)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C25H29N3O3/c1-2-3-11-31-26-21-22-20-16-13-19-25(9-10-27(19)14-15(16)8-12-30-22)17-6-4-5-7-18(17)28(23(20)25)24(21)29/h4-8,16,19-20,22-23H,2-3,9-14H2,1H3/b26-21+/t16-,19-,20-,22+,23-,25+/m0/s1
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n/an/a 880n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
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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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/beta


(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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n/an/a 933n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
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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n/an/a 940n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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))
BDBM50232894
PNG
(CHEMBL4060206)
Show SMILES [H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])\C(=N/OCC(C)C)C(=O)N6c7ccccc7[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H] |r,c:5|
Show InChI InChI=1S/C25H29N3O3/c1-14(2)13-31-26-21-22-20-16-11-19-25(8-9-27(19)12-15(16)7-10-30-22)17-5-3-4-6-18(17)28(23(20)25)24(21)29/h3-7,14,16,19-20,22-23H,8-13H2,1-2H3/b26-21+/t16-,19-,20-,22+,23-,25+/m0/s1
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n/an/a 1.10E+3n/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 human tsA201 cells assessed as inhibition of glycine-induced rece...


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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