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Compile Data Set for Download or QSAR

Found 78 hits with Last Name = 'yousuf' and Initial = 'a'   
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
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50102692
PNG
(4-Benzyloxy-N-(1-dimethylamino-cyclopentylmethyl)-...)
Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)NCC1(CCCC1)N(C)C
Show InChI InChI=1S/C24H32N2O4/c1-26(2)24(12-8-9-13-24)17-25-23(27)19-14-20(28-3)22(21(15-19)29-4)30-16-18-10-6-5-7-11-18/h5-7,10-11,14-15H,8-9,12-13,16-17H2,1-4H3,(H,25,27)
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n/an/a 3.80n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50102692
PNG
(4-Benzyloxy-N-(1-dimethylamino-cyclopentylmethyl)-...)
Show SMILES COc1cc(cc(OC)c1OCc1ccccc1)C(=O)NCC1(CCCC1)N(C)C
Show InChI InChI=1S/C24H32N2O4/c1-26(2)24(12-8-9-13-24)17-25-23(27)19-14-20(28-3)22(21(15-19)29-4)30-16-18-10-6-5-7-11-18/h5-7,10-11,14-15H,8-9,12-13,16-17H2,1-4H3,(H,25,27)
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n/an/a 16n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537022
PNG
(CHEMBL4587165)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C24H46N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23(27)26-22(24(28)29)19-17-18-21-25;/h9-10,22H,2-8,11-21,25H2,1H3,(H,26,27)(H,28,29);1H/b10-9-;/t22-;/m0./s1
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n/an/a 26n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537040
PNG
(CHEMBL4515597)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCSC)C(O)=O |r|
Show InChI InChI=1S/C23H43NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(25)24-21(23(26)27)19-20-28-2/h10-11,21H,3-9,12-20H2,1-2H3,(H,24,25)(H,26,27)/b11-10-/t21-/m0/s1
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n/an/a 29n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537034
PNG
(CHEMBL4572247)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCN)C(O)=O |r|
Show InChI InChI=1S/C23H44N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(26)25-21(23(27)28)18-17-20-24;/h9-10,21H,2-8,11-20,24H2,1H3,(H,25,26)(H,27,28);1H/b10-9-;/t21-;/m0./s1
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n/an/a 32n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537044
PNG
(CHEMBL4562565)
Show SMILES Cl.Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCNC(N)=N)C(O)=O |r|
Show InChI InChI=1S/C24H46N4O3.2ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(29)28-21(23(30)31)18-17-20-27-24(25)26;;/h9-10,21H,2-8,11-20H2,1H3,(H,28,29)(H,30,31)(H4,25,26,27);2*1H/b10-9-;;/t21-;;/m0../s1
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n/an/a 48n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537033
PNG
(CHEMBL4535356)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C24H46N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23(27)26-22(24(28)29)19-17-18-21-25;/h9-10,22H,2-8,11-21,25H2,1H3,(H,26,27)(H,28,29);1H/b10-9-;/t22-;/m1./s1
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University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537043
PNG
(CHEMBL4227139)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O |r|
Show InChI InChI=1S/C29H44N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-28(32)31-27(29(33)34)22-24-23-30-26-20-18-17-19-25(24)26/h9-10,17-20,23,27,30H,2-8,11-16,21-22H2,1H3,(H,31,32)(H,33,34)/b10-9-/t27-/m0/s1
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University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537049
PNG
(CHEMBL4527071)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](CO)C(O)=O |r|
Show InChI InChI=1S/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)22-19(18-23)21(25)26/h9-10,19,23H,2-8,11-18H2,1H3,(H,22,24)(H,25,26)/b10-9-/t19-/m1/s1
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n/an/a 65n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537023
PNG
(CHEMBL4542099)
Show SMILES Cl.Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](CCCNC(N)=N)C(O)=O |r|
Show InChI InChI=1S/C24H46N4O3.2ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(29)28-21(23(30)31)18-17-20-27-24(25)26;;/h9-10,21H,2-8,11-20H2,1H3,(H,28,29)(H,30,31)(H4,25,26,27);2*1H/b10-9-;;/t21-;;/m1../s1
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n/an/a 69n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537054
PNG
(CHEMBL4549008)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCCN)C(=O)OC |r|
Show InChI InChI=1S/C25H48N2O3.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24(28)27-23(25(29)30-2)20-18-19-22-26;/h10-11,23H,3-9,12-22,26H2,1-2H3,(H,27,28);1H/b11-10-;/t23-;/m0./s1
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n/an/a 91n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50256745
PNG
((2S)-2-amino-3-((2-(benzyloxy)phenyl)(3-fluorophen...)
Show SMILES N[C@@H](COC(c1cccc(F)c1)c1ccccc1OCc1ccccc1)C(O)=O |r|
Show InChI InChI=1S/C23H22FNO4/c24-18-10-6-9-17(13-18)22(29-15-20(25)23(26)27)19-11-4-5-12-21(19)28-14-16-7-2-1-3-8-16/h1-13,20,22H,14-15,25H2,(H,26,27)/t20-,22?/m0/s1
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n/an/a 100n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of full length human GlyT2 expressed in FreeStyle 293-F suspension cells incubated for 30 mins before [3H]glycine addition and measured af...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50023924
PNG
(CHEMBL3325507)
Show SMILES CN1CCC(CC1)NC(=O)c1ccc(COc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H23F3N2O2/c1-26-12-10-18(11-13-26)25-20(27)16-4-2-15(3-5-16)14-28-19-8-6-17(7-9-19)21(22,23)24/h2-9,18H,10-14H2,1H3,(H,25,27)
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n/an/a 105n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Reversible inhibition of recombinant human GlyT2 expressed in HEK293 cells assessed as reduction in [3H]-glycine uptake after 2 hrs by top count assa...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537031
PNG
(CHEMBL4540633)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](Cc1cnc[nH]1)C(O)=O |r|
Show InChI InChI=1S/C24H41N3O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28)27-22(24(29)30)18-21-19-25-20-26-21;/h9-10,19-20,22H,2-8,11-18H2,1H3,(H,25,26)(H,27,28)(H,29,30);1H/b10-9-;/t22-;/m0./s1
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n/an/a 130n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537017
PNG
(CHEMBL4228560)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CC(C)C)C(O)=O |r|
Show InChI InChI=1S/C24H45NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)25-22(24(27)28)20-21(2)3/h11-12,21-22H,4-10,13-20H2,1-3H3,(H,25,26)(H,27,28)/b12-11-/t22-/m0/s1
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n/an/a 143n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537029
PNG
(CHEMBL4592570)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCc1ccccc1)C(O)=O |r|
Show InChI InChI=1S/C28H45NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-27(30)29-26(28(31)32)24-23-25-20-17-16-18-21-25/h9-10,16-18,20-21,26H,2-8,11-15,19,22-24H2,1H3,(H,29,30)(H,31,32)/b10-9-/t26-/m0/s1
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University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537045
PNG
(CHEMBL4562110)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCN)C(O)=O |r|
Show InChI InChI=1S/C22H42N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(25)24-20(18-19-23)22(26)27;/h9-10,20H,2-8,11-19,23H2,1H3,(H,24,25)(H,26,27);1H/b10-9-;/t20-;/m0./s1
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University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537035
PNG
(CHEMBL4549529)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CN)C(O)=O |r|
Show InChI InChI=1S/C21H40N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)23-19(18-22)21(25)26;/h9-10,19H,2-8,11-18,22H2,1H3,(H,23,24)(H,25,26);1H/b10-9-;/t19-;/m0./s1
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University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537028
PNG
(CHEMBL4228763)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
Show InChI InChI=1S/C27H43NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-26(29)28-25(27(30)31)23-24-20-17-16-18-21-24/h9-10,16-18,20-21,25H,2-8,11-15,19,22-23H2,1H3,(H,28,29)(H,30,31)/b10-9-/t25-/m0/s1
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n/an/a 214n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537019
PNG
(CHEMBL4526987)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCC)C(O)=O |r|
Show InChI InChI=1S/C24H45NO3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23(26)25-22(24(27)28)20-6-4-2/h12-13,22H,3-11,14-21H2,1-2H3,(H,25,26)(H,27,28)/b13-12-/t22-/m0/s1
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n/an/a 259n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537048
PNG
(CHEMBL4576431)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](CCSC)C(O)=O |r|
Show InChI InChI=1S/C23H43NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(25)24-21(23(26)27)19-20-28-2/h10-11,21H,3-9,12-20H2,1-2H3,(H,24,25)(H,26,27)/b11-10-/t21-/m1/s1
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University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537032
PNG
(CHEMBL4559571)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](Cc1cnc[nH]1)C(O)=O |r|
Show InChI InChI=1S/C24H41N3O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28)27-22(24(29)30)18-21-19-25-20-26-21;/h9-10,19-20,22H,2-8,11-18H2,1H3,(H,25,26)(H,27,28)(H,29,30);1H/b10-9-;/t22-;/m1./s1
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n/an/a 313n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537046
PNG
(CHEMBL4531406)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)O[C@H](CC([O-])=O)C[N+](C)(C)C |r|
Show InChI InChI=1S/C25H47NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h12-13,23H,5-11,14-22H2,1-4H3/b13-12-/t23-/m1/s1
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n/an/a 340n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Reversible non-competitive inhibition of human GlyT2a expressed in Xenopus laevis oocytes by two-electrode voltage clamp electrophysiology


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537041
PNG
(CHEMBL4515758)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CO)C(O)=O |r|
Show InChI InChI=1S/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)22-19(18-23)21(25)26/h9-10,19,23H,2-8,11-18H2,1H3,(H,22,24)(H,25,26)/b10-9-/t19-/m0/s1
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n/an/a 496n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537018
PNG
(CHEBI:73723 | Oleoyl Glycine)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)NCC(O)=O
Show InChI InChI=1S/C20H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(22)21-18-20(23)24/h9-10H,2-8,11-18H2,1H3,(H,21,22)(H,23,24)/b10-9-
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n/an/a 500n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Reversible non-competitive inhibition of human GlyT2a expressed in Xenopus laevis oocytes by two-electrode voltage clamp electrophysiology


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537018
PNG
(CHEBI:73723 | Oleoyl Glycine)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)NCC(O)=O
Show InChI InChI=1S/C20H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(22)21-18-20(23)24/h9-10H,2-8,11-18H2,1H3,(H,21,22)(H,23,24)/b10-9-
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n/an/a 500n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537036
PNG
(CHEMBL4559157)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)NCCCCCN
Show InChI InChI=1S/C23H46N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23(26)25-22-19-16-18-21-24/h9-10H,2-8,11-22,24H2,1H3,(H,25,26)/b10-9-
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University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537024
PNG
(CHEBI:17490 | CHEMBL3392050)
Show SMILES CCCCCCCCCCCCCCCC(=O)O[C@H](CC([O-])=O)C[N+](C)(C)C
Show InChI InChI=1S/C23H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(27)28-21(19-22(25)26)20-24(2,3)4/h21H,5-20H2,1-4H3/t21-/m1/s1
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n/an/a 600n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Reversible non-competitive inhibition of human GlyT2a expressed in Xenopus laevis oocytes by two-electrode voltage clamp electrophysiology


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537042
PNG
(CHEMBL4526841)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CC(N)=O)C(O)=O |r|
Show InChI InChI=1S/C22H40N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(26)24-19(22(27)28)18-20(23)25/h9-10,19H,2-8,11-18H2,1H3,(H2,23,25)(H,24,26)(H,27,28)/b10-9-/t19-/m0/s1
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University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537025
PNG
(CHEMBL4545242)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CC(O)=O)C(O)=O |r|
Show InChI InChI=1S/C22H39NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)23-19(22(27)28)18-21(25)26/h9-10,19H,2-8,11-18H2,1H3,(H,23,24)(H,25,26)(H,27,28)/b10-9-/t19-/m0/s1
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n/an/a 865n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537047
PNG
(CHEMBL4543598)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](C(C)C)C(O)=O |r|
Show InChI InChI=1S/C23H43NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(25)24-22(20(2)3)23(26)27/h11-12,20,22H,4-10,13-19H2,1-3H3,(H,24,25)(H,26,27)/b12-11-/t22-/m1/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537038
PNG
(CHEMBL4516669)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](C(C)C)C(O)=O |r|
Show InChI InChI=1S/C23H43NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(25)24-22(20(2)3)23(26)27/h11-12,20,22H,4-10,13-19H2,1-3H3,(H,24,25)(H,26,27)/b12-11-/t22-/m0/s1
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n/an/a 1.17E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537051
PNG
(CHEMBL226397 | Oleoyl L-Alanine)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](C)C(O)=O
Show InChI InChI=1S/C21H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(23)22-19(2)21(24)25/h10-11,19H,3-9,12-18H2,1-2H3,(H,22,23)(H,24,25)/b11-10-/t19-/m0/s1
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n/an/a 1.23E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537050
PNG
(CHEMBL4576550)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](CC(O)=O)C(O)=O |r|
Show InChI InChI=1S/C22H39NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)23-19(22(27)28)18-21(25)26/h9-10,19H,2-8,11-18H2,1H3,(H,23,24)(H,25,26)(H,27,28)/b10-9-/t19-/m1/s1
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n/an/a 1.81E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 2


(Homo sapiens (Human))
BDBM50537037
PNG
(CHEMBL4578795)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](C)C(O)=O |r|
Show InChI InChI=1S/C21H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(23)22-19(2)21(24)25/h10-11,19H,3-9,12-18H2,1-2H3,(H,22,23)(H,24,25)/b11-10-/t19-/m1/s1
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n/an/a 2.33E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT2a expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537022
PNG
(CHEMBL4587165)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C24H46N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23(27)26-22(24(28)29)19-17-18-21-25;/h9-10,22H,2-8,11-21,25H2,1H3,(H,26,27)(H,28,29);1H/b10-9-;/t22-;/m0./s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537031
PNG
(CHEMBL4540633)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](Cc1cnc[nH]1)C(O)=O |r|
Show InChI InChI=1S/C24H41N3O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28)27-22(24(29)30)18-21-19-25-20-26-21;/h9-10,19-20,22H,2-8,11-18H2,1H3,(H,25,26)(H,27,28)(H,29,30);1H/b10-9-;/t22-;/m0./s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537032
PNG
(CHEMBL4559571)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](Cc1cnc[nH]1)C(O)=O |r|
Show InChI InChI=1S/C24H41N3O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28)27-22(24(29)30)18-21-19-25-20-26-21;/h9-10,19-20,22H,2-8,11-18H2,1H3,(H,25,26)(H,27,28)(H,29,30);1H/b10-9-;/t22-;/m1./s1
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University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537023
PNG
(CHEMBL4542099)
Show SMILES Cl.Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](CCCNC(N)=N)C(O)=O |r|
Show InChI InChI=1S/C24H46N4O3.2ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(29)28-21(23(30)31)18-17-20-27-24(25)26;;/h9-10,21H,2-8,11-20H2,1H3,(H,28,29)(H,30,31)(H4,25,26,27);2*1H/b10-9-;;/t21-;;/m1../s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537033
PNG
(CHEMBL4535356)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](CCCCN)C(O)=O |r|
Show InChI InChI=1S/C24H46N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23(27)26-22(24(28)29)19-17-18-21-25;/h9-10,22H,2-8,11-21,25H2,1H3,(H,26,27)(H,28,29);1H/b10-9-;/t22-;/m1./s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537034
PNG
(CHEMBL4572247)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCN)C(O)=O |r|
Show InChI InChI=1S/C23H44N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(26)25-21(23(27)28)18-17-20-24;/h9-10,21H,2-8,11-20,24H2,1H3,(H,25,26)(H,27,28);1H/b10-9-;/t21-;/m0./s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537035
PNG
(CHEMBL4549529)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CN)C(O)=O |r|
Show InChI InChI=1S/C21H40N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)23-19(18-22)21(25)26;/h9-10,19H,2-8,11-18,22H2,1H3,(H,23,24)(H,25,26);1H/b10-9-;/t19-;/m0./s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537036
PNG
(CHEMBL4559157)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)NCCCCCN
Show InChI InChI=1S/C23H46N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23(26)25-22-19-16-18-21-24/h9-10H,2-8,11-22,24H2,1H3,(H,25,26)/b10-9-
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537048
PNG
(CHEMBL4576431)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](CCSC)C(O)=O |r|
Show InChI InChI=1S/C23H43NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(25)24-21(23(26)27)19-20-28-2/h10-11,21H,3-9,12-20H2,1-2H3,(H,24,25)(H,26,27)/b11-10-/t21-/m1/s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537049
PNG
(CHEMBL4527071)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](CO)C(O)=O |r|
Show InChI InChI=1S/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)22-19(18-23)21(25)26/h9-10,19,23H,2-8,11-18H2,1H3,(H,22,24)(H,25,26)/b10-9-/t19-/m1/s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537044
PNG
(CHEMBL4562565)
Show SMILES Cl.Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCNC(N)=N)C(O)=O |r|
Show InChI InChI=1S/C24H46N4O3.2ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(29)28-21(23(30)31)18-17-20-27-24(25)26;;/h9-10,21H,2-8,11-20H2,1H3,(H,28,29)(H,30,31)(H4,25,26,27);2*1H/b10-9-;;/t21-;;/m0../s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537045
PNG
(CHEMBL4562110)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCN)C(O)=O |r|
Show InChI InChI=1S/C22H42N2O3.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(25)24-20(18-19-23)22(26)27;/h9-10,20H,2-8,11-19,23H2,1H3,(H,24,25)(H,26,27);1H/b10-9-;/t20-;/m0./s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537041
PNG
(CHEMBL4515758)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CO)C(O)=O |r|
Show InChI InChI=1S/C21H39NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(24)22-19(18-23)21(25)26/h9-10,19,23H,2-8,11-18H2,1H3,(H,22,24)(H,25,26)/b10-9-/t19-/m0/s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537054
PNG
(CHEMBL4549008)
Show SMILES Cl.CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCCCN)C(=O)OC |r|
Show InChI InChI=1S/C25H48N2O3.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24(28)27-23(25(29)30-2)20-18-19-22-26;/h10-11,23H,3-9,12-22,26H2,1-2H3,(H,27,28);1H/b11-10-;/t23-;/m0./s1
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n/an/a>3.00E+3n/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent glycine transporter 1


(Homo sapiens (Human))
BDBM50537040
PNG
(CHEMBL4515597)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCSC)C(O)=O |r|
Show InChI InChI=1S/C23H43NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(25)24-21(23(26)27)19-20-28-2/h10-11,21H,3-9,12-20H2,1-2H3,(H,24,25)(H,26,27)/b11-10-/t21-/m0/s1
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University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GlyT1b expressed in Xenopus laevis oocytes assessed as reduction in channel current by two-electrode voltage clamp el...


J Med Chem 62: 2466-2484 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01775
BindingDB Entry DOI: 10.7270/Q21R6V1K
More data for this
Ligand-Target Pair
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