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Compile Data Set for Download or QSAR

Found 173 hits Enz. Inhib. hit(s) with Target = 'Glycine receptor subunit alpha-1'   
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


()
BDBM198936
PNG
(US9676786, example 5)
Show SMILES CC(C)c1cc(cc(C(C)C)c1O)C(O)=O
Show InChI InChI=1S/C13H18O3/c1-7(2)10-5-9(13(15)16)6-11(8(3)4)12(10)14/h5-8,14H,1-4H3,(H,15,16)
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US Patent
n/an/an/an/a 0.000160n/an/an/an/a



THE UNIVERSITY OF LIVERPOOL

US Patent


Assay Description
Human embryonic kidney (HEK) 293 cells (ATCC CRL 1573) and/or Xenopus laevis oocytes were used for expressing the human a1-3 glycine receptor subunit...


US Patent US9676786 (2017)


BindingDB Entry DOI: 10.7270/Q22R3PVF
More data for this
Ligand-Target Pair
Glycine


()
BDBM199088
PNG
(US9676786, example 6)
Show SMILES CC(C)c1cc(cc(C(C)C)c1O)C(=O)N1CCN(C)CC1
Show InChI InChI=1S/C18H28N2O2/c1-12(2)15-10-14(11-16(13(3)4)17(15)21)18(22)20-8-6-19(5)7-9-20/h10-13,21H,6-9H2,1-5H3
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n/an/an/an/a 0.00120n/an/an/an/a



THE UNIVERSITY OF LIVERPOOL

US Patent


Assay Description
Human embryonic kidney (HEK) 293 cells (ATCC CRL 1573) and/or Xenopus laevis oocytes were used for expressing the human a1-3 glycine receptor subunit...


US Patent US9676786 (2017)


BindingDB Entry DOI: 10.7270/Q22R3PVF
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


()
BDBM198933
PNG
(US9676786, example 2)
Show SMILES CC(C)c1cc(cc(C(C)C)c1OCc1ccccc1)C(Cl)=O
Show InChI InChI=1S/C20H23ClO2/c1-13(2)17-10-16(20(21)22)11-18(14(3)4)19(17)23-12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3
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n/an/an/an/a 0.0600n/an/an/an/a



THE UNIVERSITY OF LIVERPOOL

US Patent


Assay Description
Human embryonic kidney (HEK) 293 cells (ATCC CRL 1573) and/or Xenopus laevis oocytes were used for expressing the human a1-3 glycine receptor subunit...


US Patent US9676786 (2017)


BindingDB Entry DOI: 10.7270/Q22R3PVF
More data for this
Ligand-Target Pair
Glycine receptor subunit alpha-1


()
BDBM198934
PNG
(US9676786, example 3)
Show SMILES CC(C)c1cc(cc(C(C)C)c1OCc1ccccc1)C(=O)N1CC(F)C1
Show InChI InChI=1S/C23H28FNO2/c1-15(2)20-10-18(23(26)25-12-19(24)13-25)11-21(16(3)4)22(20)27-14-17-8-6-5-7-9-17/h5-11,15-16,19H,12-14H2,1-4H3
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n/an/an/an/a 0.430n/an/an/an/a



THE UNIVERSITY OF LIVERPOOL

US Patent


Assay Description
Human embryonic kidney (HEK) 293 cells (ATCC CRL 1573) and/or Xenopus laevis oocytes were used for expressing the human a1-3 glycine receptor subunit...


US Patent US9676786 (2017)


BindingDB Entry DOI: 10.7270/Q22R3PVF
More data for this
Ligand-Target Pair
Glycine


()
BDBM50416875
PNG
(AMG-073 | AMG073 HCL | CINACALCET | CINACALCET HYD...)
Show SMILES C[C@@H](NCCCc1cccc(c1)C(F)(F)F)c1cccc2ccccc12
Show InChI InChI=1S/C22H22F3N/c1-16(20-13-5-10-18-9-2-3-12-21(18)20)26-14-6-8-17-7-4-11-19(15-17)22(23,24)25/h2-5,7,9-13,15-16,26H,6,8,14H2,1H3/t16-/m1/s1
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n/an/an/an/a 320n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM50001885
PNG
((risperidone)3-{2-[4-(6-Fluoro-benzo[d]isoxazol-3-...)
Show SMILES Cc1nc2CCCCn2c(=O)c1CCN1CCC(CC1)c1noc2cc(F)ccc12
Show InChI InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3
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n/an/an/an/a 320n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM50340481
PNG
(Avodart | CHEMBL1200969 | DUTASTERIDE | GG-745 | G...)
Show SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4NC(=O)C=C[C@]34C)[C@@H]1CC[C@@H]2C(=O)Nc1cc(ccc1C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C27H30F6N2O2/c1-24-11-9-17-15(4-8-21-25(17,2)12-10-22(36)35-21)16(24)6-7-19(24)23(37)34-20-13-14(26(28,29)30)3-5-18(20)27(31,32)33/h3,5,10,12-13,15-17,19,21H,4,6-9,11H2,1-2H3,(H,34,37)(H,35,36)/t15-,16-,17-,19+,21+,24-,25+/m0/s1
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n/an/an/an/a 330n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM50012899
PNG
((Z)-5-Fluoro-2-methyl-1-((p-(methylsulfinyl)phenyl...)
Show SMILES CC1=C(CC(O)=O)c2cc(F)ccc2\C1=C/c1ccc(cc1)S(C)=O
Show InChI InChI=1S/C20H17FO3S/c1-12-17(9-13-3-6-15(7-4-13)25(2)24)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9-
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n/an/an/an/a 380n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM50030475
PNG
(7-Dehydrocholesterol | CHEBI:28940 | CHOLECALCIFER...)
Show SMILES CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)CCC1=C
Show InChI InChI=1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h12-13,19,21,24-26,28H,3,6-11,14-18H2,1-2,4-5H3/b22-12+,23-13-/t21-,24+,25-,26+,27-/m1/s1
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n/an/an/an/a 400n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM50316015
PNG
(8-hydroxyircinialactam B | CHEMBL1093847)
Show SMILES C[C@@H](CCC\C(C)=C\CCC(C)(O)CCCC1=CC(=O)N(CC(O)=O)C1)C=C1OC(=O)C(C)C1=O
Show InChI InChI=1S/C27H39NO7/c1-18(8-5-9-19(2)14-22-25(32)20(3)26(33)35-22)10-6-12-27(4,34)13-7-11-21-15-23(29)28(16-21)17-24(30)31/h10,14-15,19-20,34H,5-9,11-13,16-17H2,1-4H3,(H,30,31)/b18-10+,22-14?/t19-,20?,27?/m0/s1
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n/an/an/an/a 500n/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha 1 GlyR expressed in HEK293 cells assessed as potentiation of glycine current by whole cell patch clamp as...


Bioorg Med Chem 18: 2912-9 (2010)


Article DOI: 10.1016/j.bmc.2010.03.002
BindingDB Entry DOI: 10.7270/Q2Q240DQ
More data for this
Ligand-Target Pair
Glycine


()
BDBM50316020
PNG
((12E,20Z,18S)-8-hydroxyvariabilin | 5-((2S)-13-(fu...)
Show SMILES C[C@@H](CCC\C(C)=C\CCC(C)(O)CCCc1ccoc1)C=C1OC(=O)C(C)C1=O
Show InChI InChI=1S/C25H36O5/c1-18(8-5-9-19(2)16-22-23(26)20(3)24(27)30-22)10-6-13-25(4,28)14-7-11-21-12-15-29-17-21/h10,12,15-17,19-20,28H,5-9,11,13-14H2,1-4H3/b18-10+,22-16?/t19-,20?,25?/m0/s1
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n/an/an/an/a 1.20E+3n/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant alpha 1 GlyR expressed in HEK293 cells assessed as potentiation of glycine current by whole cell patch clamp as...


Bioorg Med Chem 18: 2912-9 (2010)


Article DOI: 10.1016/j.bmc.2010.03.002
BindingDB Entry DOI: 10.7270/Q2Q240DQ
More data for this
Ligand-Target Pair
Glycine


()
BDBM26948
PNG
(8-[4,4-bis(4-fluorophenyl)butyl]-1-phenyl-1,3,8-tr...)
Show SMILES Fc1ccc(cc1)C(CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccc(F)cc1
Show InChI InChI=1S/C29H31F2N3O/c30-24-12-8-22(9-13-24)27(23-10-14-25(31)15-11-23)7-4-18-33-19-16-29(17-20-33)28(35)32-21-34(29)26-5-2-1-3-6-26/h1-3,5-6,8-15,27H,4,7,16-21H2,(H,32,35)
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n/an/an/an/a 1.20E+3n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM60994
PNG
((10R,10aR)-6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tet...)
Show SMILES CCCCCc1cc(O)c2[C@@H]3C=C(C)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C21H30O2/c1-5-6-7-8-15-12-18(22)20-16-11-14(2)9-10-17(16)21(3,4)23-19(20)13-15/h11-13,16-17,22H,5-10H2,1-4H3/t16-,17-/m1/s1
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n/an/an/an/a 1.30E+3n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM50048280
PNG
(6-(3-(1-Adamantyl)-4-methoxyphenyl)-2-naphthoic ac...)
Show SMILES COc1ccc(cc1C12CC3CC(CC(C3)C1)C2)-c1ccc2cc(ccc2c1)C(O)=O
Show InChI InChI=1S/C28H28O3/c1-31-26-7-6-23(21-2-3-22-12-24(27(29)30)5-4-20(22)11-21)13-25(26)28-14-17-8-18(15-28)10-19(9-17)16-28/h2-7,11-13,17-19H,8-10,14-16H2,1H3,(H,29,30)
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n/an/an/an/a 1.30E+3n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM50334150
PNG
(1-(1-(4,4-bis(4-fluorophenyl)butyl)piperidin-4-yl)...)
Show SMILES Fc1ccc(cc1)C(CCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccc(F)cc1
Show InChI InChI=1S/C28H29F2N3O/c29-22-11-7-20(8-12-22)25(21-9-13-23(30)14-10-21)4-3-17-32-18-15-24(16-19-32)33-27-6-2-1-5-26(27)31-28(33)34/h1-2,5-14,24-25H,3-4,15-19H2,(H,31,34)
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n/an/an/an/a 1.70E+3n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM50363397
PNG
(CHEMBL1946170 | REGORAFENIB)
Show SMILES CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)c(F)c2)ccn1
Show InChI InChI=1S/C21H15ClF4N4O3/c1-27-19(31)18-10-13(6-7-28-18)33-12-3-5-17(16(23)9-12)30-20(32)29-11-2-4-15(22)14(8-11)21(24,25)26/h2-10H,1H3,(H,27,31)(H2,29,30,32)
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n/an/an/an/a 1.80E+3n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM50022889
PNG
((2,8-Bis-trifluoromethyl-quinolin-4-yl)-(1-methyl-...)
Show SMILES OC(C1CCCCN1)c1cc(nc2c(cccc12)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C17H16F6N2O/c18-16(19,20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,22)23)25-14(9)11/h3-5,8,12,15,24,26H,1-2,6-7H2
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n/an/an/an/a 2.50E+3n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM50043280
PNG
(4'-((1,4'-dimethyl-2'-propyl(2,6'-bi-1H-benzimidaz...)
Show SMILES CCCc1nc2c(C)cc(cc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)-c1nc2ccccc2n1C
Show InChI InChI=1S/C33H30N4O2/c1-4-9-30-35-31-21(2)18-24(32-34-27-12-7-8-13-28(27)36(32)3)19-29(31)37(30)20-22-14-16-23(17-15-22)25-10-5-6-11-26(25)33(38)39/h5-8,10-19H,4,9,20H2,1-3H3,(H,38,39)
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n/an/an/an/a 3.20E+3n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM24226
PNG
(1-[(4-fluorophenyl)methyl]-N-{1-[2-(4-methoxypheny...)
Show SMILES COc1ccc(CCN2CCC(CC2)Nc2nc3ccccc3n2Cc2ccc(F)cc2)cc1
Show InChI InChI=1S/C28H31FN4O/c1-34-25-12-8-21(9-13-25)14-17-32-18-15-24(16-19-32)30-28-31-26-4-2-3-5-27(26)33(28)20-22-6-10-23(29)11-7-22/h2-13,24H,14-20H2,1H3,(H,30,31)
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n/an/an/an/a 4.20E+3n/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Potentiation of human GlyR-alpha1 expressed in Xenopus laevis oocytes assessed as induction of glycine-activated currents after 1 to 4 days by two-el...


J Med Chem 58: 2958-66 (2015)


Article DOI: 10.1021/jm501873p
BindingDB Entry DOI: 10.7270/Q22F7Q4V
More data for this
Ligand-Target Pair
Glycine


()
BDBM18133
PNG
(2-aminoacetic acid | CHEMBL773 | Glycine | [14C]Gl...)
Show SMILES NCC(O)=O
Show InChI InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)
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n/an/an/an/a 9.55E+4n/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Antagonist activity at human glycine alpha-1 receptor in HEK293 cells by FMP assay


J Med Chem 50: 4616-29 (2007)


Article DOI: 10.1021/jm070574f
BindingDB Entry DOI: 10.7270/Q2J67HRC
More data for this
Ligand-Target Pair
Glycine


()
BDBM50022784
PNG
((R)-N-methyl-3-phenyl-3-(o-tolyloxy)propan-1-amine...)
Show SMILES CNCCC(Oc1ccccc1C)c1ccccc1
Show InChI InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3
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1.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 27: 699-711 (2002)


Article DOI: 10.1016/S0893-133X(02)00346-9
BindingDB Entry DOI: 10.7270/Q2GQ6W98
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM82071
PNG
(CAS_93413-69-5 | CAS_99300-78-4 | NSC_62923 | VENL...)
Show SMILES COc1ccc(cc1)C(CN(C)C)C1(O)CCCCC1
Show InChI InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3
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1.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 25: 871-80 (2001)


Article DOI: 10.1016/S0893-133X(01)00298-6
BindingDB Entry DOI: 10.7270/Q25M648W
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM50022784
PNG
((R)-N-methyl-3-phenyl-3-(o-tolyloxy)propan-1-amine...)
Show SMILES CNCCC(Oc1ccccc1C)c1ccccc1
Show InChI InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3
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1.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 27: 699-711 (2002)


Article DOI: 10.1016/S0893-133X(02)00346-9
BindingDB Entry DOI: 10.7270/Q2GQ6W98
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM82071
PNG
(CAS_93413-69-5 | CAS_99300-78-4 | NSC_62923 | VENL...)
Show SMILES COc1ccc(cc1)C(CN(C)C)C1(O)CCCCC1
Show InChI InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3
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1.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 25: 871-80 (2001)


Article DOI: 10.1016/S0893-133X(01)00298-6
BindingDB Entry DOI: 10.7270/Q25M648W
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM84745
PNG
(CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...)
Show SMILES CNCC[C@H](Oc1cccc2ccccc12)c1cccs1
Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 25: 871-80 (2001)


Article DOI: 10.1016/S0893-133X(01)00298-6
BindingDB Entry DOI: 10.7270/Q25M648W
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM84745
PNG
(CAS_136434-34-9 | DULOXETINE | LY-248686 | LY24868...)
Show SMILES CNCC[C@H](Oc1cccc2ccccc12)c1cccs1
Show InChI InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1
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1.00E+3n/an/an/an/an/an/an/an/a



Lilly Research Laboratories

Curated by PDSP Ki Database




Neuropsychopharmacology 25: 871-80 (2001)


Article DOI: 10.1016/S0893-133X(01)00298-6
BindingDB Entry DOI: 10.7270/Q25M648W
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM22869
PNG
(6-chloro-10-(4-methylpiperazin-1-yl)-2,9-diazatric...)
Show SMILES CN1CCN(CC1)C1=c2ccccc2=Nc2ccc(Cl)cc2N1
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,21H,8-11H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Synthélabo Recherche

Curated by PDSP Ki Database




J Pharmacol Exp Ther 280: 83-97 (1997)


BindingDB Entry DOI: 10.7270/Q2NZ865X
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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>1.00E+4n/an/an/an/an/an/an/an/a



Synthélabo Recherche

Curated by PDSP Ki Database




J Pharmacol Exp Ther 280: 83-97 (1997)


BindingDB Entry DOI: 10.7270/Q2NZ865X
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM50133817
PNG
(4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic ...)
Show SMILES CC(C)(C)c1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1
Show InChI InChI=1S/C20H25ClN4O/c1-20(2,3)15-6-8-16(9-7-15)23-19(26)25-13-11-24(12-14-25)18-17(21)5-4-10-22-18/h4-10H,11-14H2,1-3H3,(H,23,26)
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>1.00E+4n/an/an/an/an/an/an/an/a



Pudue Pharma Discovery Research

Curated by PDSP Ki Database




J Pharmacol Exp Ther 306: 377-86 (2003)


Article DOI: 10.1124/jpet.102.045674
BindingDB Entry DOI: 10.7270/Q2TX3CX5
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM22913
PNG
(CHEMBL1237146 | CHEMBL498770 | Iodophenpropit | {[...)
Show SMILES NC(SCCCc1cnc[nH]1)=NCCc1ccc(I)cc1
Show InChI InChI=1S/C15H19IN4S/c16-13-5-3-12(4-6-13)7-8-19-15(17)21-9-1-2-14-10-18-11-20-14/h3-6,10-11H,1-2,7-9H2,(H2,17,19)(H,18,20)
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>1.00E+4n/an/an/an/an/an/an/an/a



Vrije Universiteit

Curated by PDSP Ki Database




Br J Pharmacol 116: 2315-21 (1995)


BindingDB Entry DOI: 10.7270/Q2ZK5F64
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM81790
PNG
(Amisulpride | CAS_71675-85-9 | NSC_2159)
Show SMILES CCN1CCCC1CNC(=O)c1cc(c(N)cc1OC)S(=O)(=O)CC
Show InChI InChI=1S/C17H27N3O4S/c1-4-20-8-6-7-12(20)11-19-17(21)13-9-16(25(22,23)5-2)14(18)10-15(13)24-3/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21)
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>1.00E+4n/an/an/an/an/an/an/an/a



Synthélabo Recherche

Curated by PDSP Ki Database




J Pharmacol Exp Ther 280: 83-97 (1997)


BindingDB Entry DOI: 10.7270/Q2NZ865X
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM22914
PNG
(CHEMBL260374 | N-cyclohexyl-4-(1H-imidazol-5-yl)pi...)
Show SMILES S=C(NC1CCCCC1)N1CCC(CC1)c1cnc[nH]1
Show InChI InChI=1S/C15H24N4S/c20-15(18-13-4-2-1-3-5-13)19-8-6-12(7-9-19)14-10-16-11-17-14/h10-13H,1-9H2,(H,16,17)(H,18,20)
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Vrije Universiteit

Curated by PDSP Ki Database




Br J Pharmacol 116: 2315-21 (1995)


BindingDB Entry DOI: 10.7270/Q2ZK5F64
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM50016570
PNG
(CHEMBL3274977)
Show SMILES CN1CCC2(CNc3ccccc23)C1
Show InChI InChI=1S/C12H16N2/c1-14-7-6-12(9-14)8-13-11-5-3-2-4-10(11)12/h2-5,13H,6-9H2,1H3
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n/an/a 2.82E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


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


J Med Chem 20: 1448-51 (1977)


Article DOI: 10.1021/jm00221a016
BindingDB Entry DOI: 10.7270/Q22F7Q02
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM50016623
PNG
(CHEMBL3274622)
Show SMILES CC(=O)N1CC2(CCCC2)c2ccccc12
Show InChI InChI=1S/C14H17NO/c1-11(16)15-10-14(8-4-5-9-14)12-6-2-3-7-13(12)15/h2-3,6-7H,4-5,8-10H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


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


J Med Chem 20: 1448-51 (1977)


Article DOI: 10.1021/jm00221a016
BindingDB Entry DOI: 10.7270/Q22F7Q02
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM50016624
PNG
(CHEMBL3274978)
Show SMILES CC(=O)N1CCc2ccccc12
Show InChI InChI=1S/C10H11NO/c1-8(12)11-7-6-9-4-2-3-5-10(9)11/h2-5H,6-7H2,1H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


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


J Med Chem 20: 1448-51 (1977)


Article DOI: 10.1021/jm00221a016
BindingDB Entry DOI: 10.7270/Q22F7Q02
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM50016625
PNG
(CHEMBL3274979)
Show SMILES CC1N(C(C)=O)c2ccccc2C1(C)C
Show InChI InChI=1S/C13H17NO/c1-9-13(3,4)11-7-5-6-8-12(11)14(9)10(2)15/h5-9H,1-4H3
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n/an/a>1.00E+6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


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


J Med Chem 20: 1448-51 (1977)


Article DOI: 10.1021/jm00221a016
BindingDB Entry DOI: 10.7270/Q22F7Q02
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM50016626
PNG
(CHEMBL3274623)
Show SMILES CN1CCC2(C1)CN(C(C)=O)c1ccccc21
Show InChI InChI=1S/C14H18N2O/c1-11(17)16-10-14(7-8-15(2)9-14)12-5-3-4-6-13(12)16/h3-6H,7-10H2,1-2H3
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n/an/a 2.36E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


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


J Med Chem 20: 1448-51 (1977)


Article DOI: 10.1021/jm00221a016
BindingDB Entry DOI: 10.7270/Q22F7Q02
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM50016663
PNG
(CHEMBL3274624)
Show SMILES CC(=O)N1CC2(CCN(Cc3ccccc3)C2)c2ccccc12
Show InChI InChI=1S/C20H22N2O.C2H2O4/c1-16(23)22-15-20(18-9-5-6-10-19(18)22)11-12-21(14-20)13-17-7-3-2-4-8-17;3-1(4)2(5)6/h2-10H,11-15H2,1H3;(H,3,4)(H,5,6)
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n/an/a 3.10E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


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


J Med Chem 20: 1448-51 (1977)


Article DOI: 10.1021/jm00221a016
BindingDB Entry DOI: 10.7270/Q22F7Q02
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM50016664
PNG
(CHEMBL3274975)
Show SMILES CC(=O)N1CC2(CCN(CC=C)C2)c2ccccc12
Show InChI InChI=1S/C16H20N2O.C2H2O4/c1-3-9-17-10-8-16(11-17)12-18(13(2)19)15-7-5-4-6-14(15)16;3-1(4)2(5)6/h3-7H,1,8-12H2,2H3;(H,3,4)(H,5,6)
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n/an/a 6.79E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


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


J Med Chem 20: 1448-51 (1977)


Article DOI: 10.1021/jm00221a016
BindingDB Entry DOI: 10.7270/Q22F7Q02
More data for this
Ligand-Target Pair
Glycine, non-strychnine


(RAT)
BDBM50016665
PNG
(CHEMBL3274976)
Show SMILES CC(=O)N1CC2(CCNC2)c2ccccc12
Show InChI InChI=1S/C13H16N2O.C2H2O4/c1-10(16)15-9-13(6-7-14-8-13)11-4-2-3-5-12(11)15;3-1(4)2(5)6/h2-5,14H,6-9H2,1H3;(H,3,4)(H,5,6)
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n/an/a 2.95E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


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


J Med Chem 20: 1448-51 (1977)


Article DOI: 10.1021/jm00221a016
BindingDB Entry DOI: 10.7270/Q22F7Q02
More data for this
Ligand-Target Pair
Glycine


()
BDBM50208059
PNG
(CHEMBL412384)
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 alpha1betaGlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)


Article DOI: 10.1021/jm070003n
BindingDB Entry DOI: 10.7270/Q2GB23QT
More data for this
Ligand-Target Pair
Glycine


()
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 9.80E+3n/an/an/an/an/an/a



University of Copenhagen

Curated by ChEMBL


Assay Description
Activity at human alpha1GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)


Article DOI: 10.1021/jm070003n
BindingDB Entry DOI: 10.7270/Q2GB23QT
More data for this
Ligand-Target Pair
Glycine


()
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 alpha1GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)


Article DOI: 10.1021/jm070003n
BindingDB Entry DOI: 10.7270/Q2GB23QT
More data for this
Ligand-Target Pair
Glycine


()
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 alpha1betaGlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)


Article DOI: 10.1021/jm070003n
BindingDB Entry DOI: 10.7270/Q2GB23QT
More data for this
Ligand-Target Pair
Glycine


()
BDBM50208059
PNG
(CHEMBL412384)
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 alpha1GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)


Article DOI: 10.1021/jm070003n
BindingDB Entry DOI: 10.7270/Q2GB23QT
More data for this
Ligand-Target Pair
Glycine


()
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 alpha1betaGlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)


Article DOI: 10.1021/jm070003n
BindingDB Entry DOI: 10.7270/Q2GB23QT
More data for this
Ligand-Target Pair
Glycine


()
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 alpha1GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)


Article DOI: 10.1021/jm070003n
BindingDB Entry DOI: 10.7270/Q2GB23QT
More data for this
Ligand-Target Pair
Glycine


()
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 alpha1betaGlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)


Article DOI: 10.1021/jm070003n
BindingDB Entry DOI: 10.7270/Q2GB23QT
More data for this
Ligand-Target Pair
Glycine


()
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 alpha1GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)


Article DOI: 10.1021/jm070003n
BindingDB Entry DOI: 10.7270/Q2GB23QT
More data for this
Ligand-Target Pair
Glycine


()
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 alpha1GlyR expressed in HEK293 cells by FMP assay


J Med Chem 50: 1610-7 (2007)


Article DOI: 10.1021/jm070003n
BindingDB Entry DOI: 10.7270/Q2GB23QT
More data for this
Ligand-Target Pair
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