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Compile Data Set for Download or QSAR

Found 34 hits Enz. Inhib. hit(s) with Target = 'Glycine receptor subunit alpha-2' AND taxid = 9606   
Target
(Institution)
LigandTarget
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-2


(Homo sapiens)
BDBM50411311
PNG
(CHEMBL2113267)
Show SMILES C[C@H]1[C@H]2[C@@H](OC1=O)[C@H](O)[C@]13C4OC(=O)[C@]21OC1OC(=O)[C@H](O)C31[C@@H]([C@H]4O)C(C)(C)C
Show InChI InChI=1S/C20H24O10/c1-5-6-8(27-13(5)24)10(22)19-12-7(21)9(17(2,3)4)18(19)11(23)14(25)29-16(18)30-20(6,19)15(26)28-12/h5-12,16,21-23H,1-4H3/t5-,6?,7+,8+,9-,10-,11-,12?,16?,18?,19+,20+/m0/s1
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n/an/a 1.30E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50292287
PNG
(CHEMBL465161 | GINKGOLIDE A | ginkgolide-A)
Show SMILES C[C@@H]1C(=O)O[C@H]2C[C@@]34[C@H]5C[C@@H](C(C)(C)C)[C@@]33[C@@H](O)C(=O)O[C@H]3O[C@@]4(C(=O)O5)[C@@]12O
Show InChI InChI=1S/C20H24O9/c1-7-12(22)26-10-6-17-9-5-8(16(2,3)4)18(17)11(21)13(23)28-15(18)29-20(17,14(24)27-9)19(7,10)25/h7-11,15,21,25H,5-6H2,1-4H3/t7-,8+,9-,10+,11+,15+,17-,18+,19-,20-/m1/s1
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n/an/a 2.10E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50251276
PNG
(BN 52021 | CHEMBL514432 | GINKOLIDE B | Gingkolide...)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@@]34[C@H]5C[C@@H](C(C)(C)C)[C@@]33[C@@H](O)C(=O)O[C@H]3O[C@@]4(C(=O)O5)[C@@]12O
Show InChI InChI=1S/C20H24O10/c1-6-12(23)28-11-9(21)18-8-5-7(16(2,3)4)17(18)10(22)13(24)29-15(17)30-20(18,14(25)27-8)19(6,11)26/h6-11,15,21-22,26H,5H2,1-4H3/t6-,7+,8-,9+,10+,11+,15+,17+,18+,19-,20-/m1/s1
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n/an/a 3.70E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208068
PNG
((1R,3R,6R,7S,8S,9S,10R,11R,12R,13S,16S,17R)-8-tert...)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@@]34[C@H]5[C@@H](F)[C@@H](C(C)(C)C)[C@@]33[C@@H](O)C(=O)O[C@H]3O[C@]4(OC5=O)[C@@]12O
Show InChI InChI=1S/C20H23FO10/c1-5-12(24)28-11-9(22)18-6-7(21)8(16(2,3)4)17(18)10(23)14(26)29-15(17)31-20(18,19(5,11)27)30-13(6)25/h5-11,15,22-23,27H,1-4H3/t5-,6+,7-,8+,9+,10+,11+,15+,17+,18+,19-,20+/m1/s1
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n/an/a 4.60E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208060
PNG
(10-methoxy-ginkgolide C | CHEMBL221823)
Show SMILES CO[C@H]1C(=O)O[C@H]2O[C@@]34OC(=O)[C@@H]5[C@H](O)[C@@H](C(C)(C)C)[C@]12[C@]35[C@@H](O)[C@@H]1OC(=O)[C@@H](C)[C@]41O
Show InChI InChI=1S/C21H26O11/c1-6-13(24)29-11-10(23)19-7-8(22)9(17(2,3)4)18(19)12(28-5)15(26)30-16(18)32-21(19,20(6,11)27)31-14(7)25/h6-12,16,22-23,27H,1-5H3/t6-,7+,8+,9+,10+,11+,12+,16+,18+,19+,20-,21+/m1/s1
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n/an/a 7.80E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208073
PNG
(CHEMBL221821 | ginkgolide C)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@@]34O[C@@H]5OC(=O)[C@H](O)[C@@]55[C@@H]([C@H](O)C(OC3=O)[C@@]45[C@@]12O)C(C)(C)C
Show InChI InChI=1S/C20H24O11/c1-5-12(24)28-11-8(22)19-14(26)29-10-6(21)7(16(2,3)4)17(20(10,19)18(5,11)27)9(23)13(25)30-15(17)31-19/h5-11,15,21-23,27H,1-4H3/t5-,6+,7+,8+,9+,10?,11+,15+,17+,18-,19-,20-/m1/s1
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n/an/a 8.20E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208076
PNG
(3,14-didehydroginkgolide A | CHEMBL373969)
Show SMILES CC1=C2[C@H](C[C@]34[C@H]5C[C@@H](C(C)(C)C)[C@@]33[C@@H](O)C(=O)O[C@H]3O[C@]24OC5=O)OC1=O
Show InChI InChI=1S/C20H22O8/c1-7-11-9(25-13(7)22)6-18-8-5-10(17(2,3)4)19(18)12(21)15(24)26-16(19)28-20(11,18)27-14(8)23/h8-10,12,16,21H,5-6H2,1-4H3/t8-,9-,10-,12-,16-,18-,19-,20+/m0/s1
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n/an/a 9.50E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208074
PNG
(CHEMBL374004 | ginkgolide J)
Show SMILES C[C@@H]1C(=O)O[C@H]2C[C@@]34O[C@@H]5OC(=O)[C@H](O)[C@@]55[C@@H]([C@H](O)C(OC3=O)[C@@]45[C@@]12O)C(C)(C)C
Show InChI InChI=1S/C20H24O10/c1-6-12(23)27-7-5-17-14(25)28-11-8(21)9(16(2,3)4)18(20(11,17)19(6,7)26)10(22)13(24)29-15(18)30-17/h6-11,15,21-22,26H,5H2,1-4H3/t6-,7+,8+,9+,10+,11?,15+,17-,18+,19-,20-/m1/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208085
PNG
((3S,8R,12R,16S,17R,21S)-3-tert-butyl-17-hydroxy-16...)
Show SMILES C[C@@H]1C(=O)OC2[C@@H]3OCO[C@H]4C(=O)OC5OC6(C(=O)OC7C[C@@H](C(C)(C)C)C45[C@]367)[C@@]12O
Show InChI InChI=1S/C21H24O10/c1-7-13(22)29-11-10-19-9-5-8(17(2,3)4)18(19)12(27-6-26-10)14(23)30-16(18)31-21(19,15(24)28-9)20(7,11)25/h7-12,16,25H,5-6H2,1-4H3/t7-,8+,9?,10+,11?,12?,16?,18?,19+,20-,21?/m1/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208081
PNG
((1R,3R,6R,7S,8S,9S,10R,11R,12R,13S,16S,17R)-8-tert...)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@@]34[C@H]5[C@@H](Cl)[C@@H](C(C)(C)C)[C@@]33[C@@H](O)C(=O)O[C@H]3O[C@]4(OC5=O)[C@@]12O
Show InChI InChI=1S/C20H23ClO10/c1-5-12(24)28-11-9(22)18-6-7(21)8(16(2,3)4)17(18)10(23)14(26)29-15(17)31-20(18,19(5,11)27)30-13(6)25/h5-11,15,22-23,27H,1-4H3/t5-,6+,7-,8+,9+,10+,11+,15+,17+,18+,19-,20+/m1/s1
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n/an/a 1.30E+4n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208082
PNG
((1R,3R,6R,7S,8S,9S,10S,11R,12R,13S,16S,17R)-9-azid...)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@@]34[C@H]5[C@@H](N=[N+]=[N-])[C@@H](C(C)(C)C)[C@]33[C@@H](OC(=O)[C@@H]3O)O[C@]4(OC5=O)[C@@]12O
Show InChI InChI=1S/C20H23N3O10/c1-5-12(26)30-11-9(24)18-6-7(22-23-21)8(16(2,3)4)17(18)10(25)14(28)31-15(17)33-20(18,19(5,11)29)32-13(6)27/h5-11,15,24-25,29H,1-4H3/t5-,6+,7-,8+,9+,10+,11+,15+,17+,18+,19-,20+/m1/s1
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n/an/a 2.90E+4n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208088
PNG
(CHEMBL225471 | methyl 2-[(1R,6R,8S,11S,14R)-8-tert...)
Show SMILES COC(=O)C(C)[C@H]1CC[C@@]23C4C[C@@H](C(C)(C)C)C22C(OC(=O)[C@@H]2O)O[C@]13C(=O)O4
Show InChI InChI=1S/C21H28O8/c1-9(14(23)26-5)10-6-7-19-12-8-11(18(2,3)4)20(19)13(22)15(24)28-17(20)29-21(10,19)16(25)27-12/h9-13,17,22H,6-8H2,1-5H3/t9?,10-,11+,12?,13+,17?,19-,20?,21+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208061
PNG
((1S,6R,8S,9S,11R,12R,13S,16S,17R)-8-tert-butyl-9-(...)
Show SMILES CCN[C@@H]1C2OC(=O)[C@]34OC5OC(=O)[C@H](O)C5([C@@H]1C(C)(C)C)[C@@]23[C@@H](O)[C@@H]1OC(=O)[C@@H](C)[C@]41O
Show InChI InChI=1S/C22H29NO10/c1-6-23-8-9(18(3,4)5)19-11(25)15(27)32-17(19)33-22-16(28)31-12(8)20(19,22)10(24)13-21(22,29)7(2)14(26)30-13/h7-13,17,23-25,29H,6H2,1-5H3/t7-,8+,9+,10+,11+,12?,13+,17?,19?,20-,21-,22+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208091
PNG
((1S,6R,8S,11R,12R,13S,16S,17R)-8-tert-butyl-6,12,1...)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@]34C5OC(=O)[C@@]3(OC3OC(=O)[C@H](O)C43[C@@H](C5=O)C(C)(C)C)[C@@]12O
Show InChI InChI=1S/C20H22O11/c1-5-12(24)28-11-8(22)18-10-6(21)7(16(2,3)4)17(18)9(23)13(25)30-15(17)31-20(18,14(26)29-10)19(5,11)27/h5,7-11,15,22-23,27H,1-4H3/t5-,7+,8+,9+,10?,11+,15?,17?,18-,19-,20+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208063
PNG
(10-methoxymethyloxy-ginkgolide A | CHEMBL225470)
Show SMILES COCO[C@H]1C(=O)O[C@H]2O[C@@]34OC(=O)[C@@H]5C[C@@H](C(C)(C)C)[C@]12[C@@]35C[C@@H]1OC(=O)[C@@H](C)[C@]41O
Show InChI InChI=1S/C22H28O10/c1-9-14(23)29-12-7-19-10-6-11(18(2,3)4)20(19)13(28-8-27-5)16(25)30-17(20)32-22(19,21(9,12)26)31-15(10)24/h9-13,17,26H,6-8H2,1-5H3/t9-,10+,11+,12+,13+,17+,19+,20+,21-,22+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208062
PNG
((1R,6R,8S,11S)-8-tert-butyl-6,13-dimethoxy-2,4,14,...)
Show SMILES CO[C@H]1C(=O)OC2O[C@@]34C(=O)OC5C[C@@H](C(C)(C)C)C12[C@]35CC(OC)OC4=O
Show InChI InChI=1S/C19H24O9/c1-16(2,3)8-6-9-17-7-10(23-4)26-14(22)19(17,13(21)25-9)28-15-18(8,17)11(24-5)12(20)27-15/h8-11,15H,6-7H2,1-5H3/t8-,9?,10?,11-,15?,17+,18?,19+/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208059
PNG
(CHEMBL412384 | N)
Show SMILES C[C@@H]1[C@H]2[C@H](C[C@@]34C5C[C@@H](C(C)(C)C)C33C(OC(=O)[C@@H]3OC(C)=O)O[C@]24C(=O)O5)OC1=O
Show InChI InChI=1S/C22H26O9/c1-8-13-10(28-15(8)24)7-20-12-6-11(19(3,4)5)21(20)14(27-9(2)23)16(25)30-18(21)31-22(13,20)17(26)29-12/h8,10-14,18H,6-7H2,1-5H3/t8-,10+,11+,12?,13+,14+,18?,20-,21?,22+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208087
PNG
(10-acetoxy-ginkgolide B | CHEMBL222222)
Show SMILES C[C@@H]1C(=O)O[C@H]2C[C@@]34C5C[C@@H](C(C)(C)C)C33C(OC(=O)[C@@H]3OC(C)=O)O[C@]4(C(=O)O5)[C@@]12O
Show InChI InChI=1S/C22H26O10/c1-8-14(24)29-12-7-19-11-6-10(18(3,4)5)20(19)13(28-9(2)23)15(25)31-17(20)32-22(19,16(26)30-11)21(8,12)27/h8,10-13,17,27H,6-7H2,1-5H3/t8-,10+,11?,12+,13+,17?,19-,20?,21-,22+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208079
PNG
((1R,6R,8S,11R)-8-tert-butyl-13-methoxy-5,15,16-tri...)
Show SMILES COC1C[C@]23C4C[C@@H](C(C)(C)C)C22C(OC(=O)[C@@H]2OC(C)=O)O[C@]3(C(=O)O4)C(=O)O1
Show InChI InChI=1S/C20H24O10/c1-8(21)26-12-13(22)29-16-19(12)9(17(2,3)4)6-10-18(19)7-11(25-5)28-15(24)20(18,30-16)14(23)27-10/h9-12,16H,6-7H2,1-5H3/t9-,10?,11?,12-,16?,18-,19?,20+/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208067
PNG
(CHEMBL223081 | methyl (2R)-2-[(1S,2R,3S,6S,8S,10S)...)
Show SMILES CO[C@@H](C(=O)OC)C12C(OC)O[C@@]34C(=O)OC(C[C@H]1C(C)(C)C)[C@]23C[C@@H]1OC(=O)[C@@H](C)[C@]41O
Show InChI InChI=1S/C23H32O10/c1-10-15(24)31-13-9-20-12-8-11(19(2,3)4)21(20,14(28-5)16(25)29-6)18(30-7)33-23(20,17(26)32-12)22(10,13)27/h10-14,18,27H,8-9H2,1-7H3/t10-,11+,12?,13+,14+,18?,20-,21?,22-,23+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208080
PNG
(1,2;3,14-dianhydro-ginkgolide C | CHEMBL412540)
Show SMILES CC1=C2C(OC1=O)=C[C@]13C4OC(=O)[C@@]21OC1OC(=O)[C@H](O)C31[C@@H]([C@H]4O)C(C)(C)C
Show InChI InChI=1S/C20H20O9/c1-6-8-7(26-13(6)23)5-18-12-9(21)10(17(2,3)4)19(18)11(22)14(24)28-16(19)29-20(8,18)15(25)27-12/h5,9-12,16,21-22H,1-4H3/t9-,10+,11+,12?,16?,18-,19?,20+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208065
PNG
(CHEMBL221355 | methyl 2-[(1R,6R,8S,11S,14E)-8-tert...)
Show SMILES COC(=O)C(\C)=C1/CC[C@@]23C4C[C@@H](C(C)(C)C)C22[C@@H](O)C(=O)OC2O[C@]13C(=O)O4
Show InChI InChI=1S/C21H26O8/c1-9(14(23)26-5)10-6-7-19-12-8-11(18(2,3)4)20(19)13(22)15(24)28-17(20)29-21(10,19)16(25)27-12/h11-13,17,22H,6-8H2,1-5H3/b10-9+/t11-,12?,13-,17?,19+,20?,21-/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208086
PNG
((1S,6R,8S,9S,11R,12R,13S,16S,17R)-8-tert-butyl-6,1...)
Show SMILES CN[C@@H]1C2OC(=O)[C@]34OC5OC(=O)[C@H](O)C5([C@@H]1C(C)(C)C)[C@@]23[C@@H](O)[C@@H]1OC(=O)[C@@H](C)[C@]41O
Show InChI InChI=1S/C21H27NO10/c1-6-13(25)29-12-9(23)19-11-7(22-5)8(17(2,3)4)18(19)10(24)14(26)31-16(18)32-21(19,15(27)30-11)20(6,12)28/h6-12,16,22-24,28H,1-5H3/t6-,7+,8+,9+,10+,11?,12+,16?,18?,19-,20-,21+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208070
PNG
((1S,6R,8S,9S,11R,12R,13S,16S,17R)-8-tert-butyl-6,9...)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@]34C5OC(=O)[C@@]3(OC3OC(=O)[C@H](O)C43[C@@H]([C@@H]5O)C(C)(C)C)[C@@]12O
Show InChI InChI=1S/C20H24O11/c1-5-12(24)28-11-8(22)18-10-6(21)7(16(2,3)4)17(18)9(23)13(25)30-15(17)31-20(18,14(26)29-10)19(5,11)27/h5-11,15,21-23,27H,1-4H3/t5-,6+,7+,8+,9+,10?,11+,15?,17?,18-,19-,20+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208069
PNG
((1S,6R,8S,9S,11R,12R,13S,16S,17R)-8-tert-butyl-6,1...)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@]34C5OC(=O)[C@@]3(OC3OC(=O)[C@H](O)C43[C@@H]([C@@H]5OC(C)=O)C(C)(C)C)[C@@]12O
Show InChI InChI=1S/C22H26O12/c1-6-14(26)31-13-10(24)20-12-8(30-7(2)23)9(18(3,4)5)19(20)11(25)15(27)33-17(19)34-22(20,16(28)32-12)21(6,13)29/h6,8-13,17,24-25,29H,1-5H3/t6-,8+,9+,10+,11+,12?,13+,17?,19?,20-,21-,22+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208075
PNG
((1S,6R,8S,11S,13S,16R,17R)-8-tert-butyl-6,17-dihyd...)
Show SMILES C[C@@H]1CO[C@H]2C[C@@]34C5C[C@@H](C(C)(C)C)C33[C@@H](O)COC3O[C@]4(C(=O)O5)[C@@]12O
Show InChI InChI=1S/C20H28O7/c1-9-7-24-13-6-17-12-5-10(16(2,3)4)18(17)11(21)8-25-15(18)27-20(17,14(22)26-12)19(9,13)23/h9-13,15,21,23H,5-8H2,1-4H3/t9-,10+,11+,12?,13+,15?,17-,18?,19-,20+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208083
PNG
((1S,6R,8S,11S,13R,16R,17R)-8-tert-butyl-6,17-dihyd...)
Show SMILES C[C@@H]1CO[C@@H]2C[C@@]34C5C[C@@H](C(C)(C)C)C33[C@@H](O)C(=O)OC3O[C@]4(C(=O)O5)[C@@]12O
Show InChI InChI=1S/C20H26O8/c1-8-7-25-11-6-17-10-5-9(16(2,3)4)18(17)12(21)13(22)27-15(18)28-20(17,14(23)26-10)19(8,11)24/h8-12,15,21,24H,5-7H2,1-4H3/t8-,9+,10?,11-,12+,15?,17-,18?,19-,20+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208092
PNG
((1S,6R,8S,9S,11R,12R,13S,16S,17R)-8-tert-butyl-6,1...)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@]34C5OC(=O)[C@@]3(OC3OC(=O)[C@H](O)C43[C@@H]([C@@H]5OC(=O)Cc3ccccc3)C(C)(C)C)[C@@]12O
Show InChI InChI=1S/C28H30O12/c1-11-20(32)37-19-16(30)26-18-14(36-13(29)10-12-8-6-5-7-9-12)15(24(2,3)4)25(26)17(31)21(33)39-23(25)40-28(26,22(34)38-18)27(11,19)35/h5-9,11,14-19,23,30-31,35H,10H2,1-4H3/t11-,14+,15+,16+,17+,18?,19+,23?,25?,26-,27-,28+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208089
PNG
((1R,6R,8S,11S,13S,16R,17R)-8-tert-butyl-16-methyl-...)
Show SMILES C[C@@H]1CO[C@H]2C[C@@]34C5C[C@@H](C(C)(C)C)C33[C@@H](O)COC3O[C@]4(CO5)[C@@]12O
Show InChI InChI=1S/C20H30O6/c1-10-7-23-14-6-17-13-5-11(16(2,3)4)19(17)12(21)8-24-15(19)26-18(17,9-25-13)20(10,14)22/h10-15,21-22H,5-9H2,1-4H3/t10-,11+,12+,13?,14+,15?,17+,18+,19?,20-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208066
PNG
((1R,2R,3S,6S,8S,10R,11R)-10-tert-butyl-2,11,16-tri...)
Show SMILES C[C@@H]1C(=O)O[C@H]2C[C@]34C5OC(=O)[C@]3(OC(O)C4[C@@H]([C@H]5O)C(C)(C)C)[C@@]12O
Show InChI InChI=1S/C18H24O8/c1-6-12(20)24-7-5-16-9-8(15(2,3)4)10(19)11(16)25-14(22)18(16,17(6,7)23)26-13(9)21/h6-11,13,19,21,23H,5H2,1-4H3/t6-,7+,8+,9?,10-,11?,13?,16+,17-,18-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208078
PNG
((6R,8S,11S,16R,17S)-8-tert-butyl-6,16,17-trihydrox...)
Show SMILES CC(C)(C)[C@@H]1CC2OC(=O)C34OC5OC(=O)[C@H](O)C15[C@@]23CC1OC(=O)[C@](C)(O)[C@]41O
Show InChI InChI=1S/C20H24O10/c1-15(2,3)7-5-8-17-6-9-19(26,16(4,25)12(23)28-9)20(17,13(24)27-8)30-14-18(7,17)10(21)11(22)29-14/h7-10,14,21,25-26H,5-6H2,1-4H3/t7-,8?,9?,10-,14?,16-,17+,18?,19-,20?/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208072
PNG
((1S,2R,3S,6S,8S,10R)-10-tert-butyl-2-hydroxy-3-met...)
Show SMILES C[C@@H]1C(=O)O[C@H]2C[C@@]34C5C[C@H](C3C(=O)O[C@]4(C(=O)O5)[C@@]12O)C(C)(C)C
Show InChI InChI=1S/C18H22O7/c1-7-12(19)23-10-6-16-9-5-8(15(2,3)4)11(16)13(20)25-18(16,14(21)24-9)17(7,10)22/h7-11,22H,5-6H2,1-4H3/t7-,8-,9?,10+,11?,16-,17-,18+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208090
PNG
((1S,8S,11S,13S,16S,17R)-8-tert-butyl-17-hydroxy-16...)
Show SMILES C[C@@H]1C(=O)O[C@H]2C[C@@]34C5C[C@@H](C(C)(C)C)C33C(OC(=O)C3=O)O[C@]4(C(=O)O5)[C@@]12O
Show InChI InChI=1S/C20H22O9/c1-7-12(22)26-10-6-17-9-5-8(16(2,3)4)18(17)11(21)13(23)28-15(18)29-20(17,14(24)27-9)19(7,10)25/h7-10,15,25H,5-6H2,1-4H3/t7-,8+,9?,10+,15?,17-,18?,19-,20+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-2


(Homo sapiens)
BDBM50208077
PNG
((1S,6R,8S,9R,11S,12R,13S,16S,17R)-8-tert-butyl-6,1...)
Show SMILES C[C@@H]1C(=O)O[C@H]2[C@H](O)[C@@]34C5OC(=O)[C@@]3(OC3OC(=O)[C@H](O)C43[C@@H]([C@H]5OS(=O)(=O)C(F)(F)F)C(C)(C)C)[C@@]12O
Show InChI InChI=1S/C21H23F3O13S/c1-5-12(27)33-11-8(25)18-10-6(37-38(31,32)21(22,23)24)7(16(2,3)4)17(18)9(26)13(28)35-15(17)36-20(18,14(29)34-10)19(5,11)30/h5-11,15,25-26,30H,1-4H3/t5-,6-,7+,8+,9+,10?,11+,15?,17?,18+,19-,20+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha2GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)

More data for this
Ligand-Target Pair