Found 8 hits Enz. Inhib. hit(s) with all data for entry = 50048930 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Glycine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50229711
(CHEMBL4074873)Show SMILES [H][C@@]12CN(C[C@]1([H])c1cnccc1N(C)C2=O)S(=O)(=O)c1ccc2occc2c1 |r| Show InChI InChI=1S/C19H17N3O4S/c1-21-17-4-6-20-9-14(17)15-10-22(11-16(15)19(21)23)27(24,25)13-2-3-18-12(8-13)5-7-26-18/h2-9,15-16H,10-11H2,1H3/t15-,16-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 450 | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Positive allosteric modulation of human glycine alpha3 receptor expressed in HEK293T cells assessed as potentiation of glycine-induced increase in ch... |
J Med Chem 60: 1105-1125 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01496
BindingDB Entry DOI: 10.7270/Q2FX7CP4 |
More data for this
Ligand-Target Pair | |
Glycine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50229714
(CHEMBL4101556)Show SMILES [H][C@]12CN(C[C@@]1([H])c1cnccc1N(C)C2=O)S(=O)(=O)c1ccc2occc2c1 |r| Show InChI InChI=1S/C19H17N3O4S/c1-21-17-4-6-20-9-14(17)15-10-22(11-16(15)19(21)23)27(24,25)13-2-3-18-12(8-13)5-7-26-18/h2-9,15-16H,10-11H2,1H3/t15-,16-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Positive allosteric modulation of human glycine alpha3 receptor expressed in HEK293T cells assessed as potentiation of glycine-induced increase in ch... |
J Med Chem 60: 1105-1125 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01496
BindingDB Entry DOI: 10.7270/Q2FX7CP4 |
More data for this
Ligand-Target Pair | |
Glycine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50229713
(CHEMBL4081234)Show SMILES [H][C@]12CN([C@H](C)[C@@]1([H])C(=O)N(C)c1ccncc21)S(=O)(=O)c1ccc2OCOc2c1 |r| Show InChI InChI=1S/C19H19N3O5S/c1-11-18-14(13-8-20-6-5-15(13)21(2)19(18)23)9-22(11)28(24,25)12-3-4-16-17(7-12)27-10-26-16/h3-8,11,14,18H,9-10H2,1-2H3/t11-,14-,18-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human glycine alpha3 receptor expressed in HEK293T cells by SPR assay |
J Med Chem 60: 1105-1125 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01496
BindingDB Entry DOI: 10.7270/Q2FX7CP4 |
More data for this
Ligand-Target Pair | |
Glycine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50229715
(CHEMBL4070615)Show SMILES [H][C@]12CN([C@@H](C)[C@@]1([H])C(=O)N(C)c1ccncc21)S(=O)(=O)c1ccc2OCOc2c1 |r| Show InChI InChI=1S/C19H19N3O5S/c1-11-18-14(13-8-20-6-5-15(13)21(2)19(18)23)9-22(11)28(24,25)12-3-4-16-17(7-12)27-10-26-16/h3-8,11,14,18H,9-10H2,1-2H3/t11-,14+,18+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human glycine alpha3 receptor expressed in HEK293T cells by SPR assay |
J Med Chem 60: 1105-1125 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01496
BindingDB Entry DOI: 10.7270/Q2FX7CP4 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Glycine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50229711
(CHEMBL4074873)Show SMILES [H][C@@]12CN(C[C@]1([H])c1cnccc1N(C)C2=O)S(=O)(=O)c1ccc2occc2c1 |r| Show InChI InChI=1S/C19H17N3O4S/c1-21-17-4-6-20-9-14(17)15-10-22(11-16(15)19(21)23)27(24,25)13-2-3-18-12(8-13)5-7-26-18/h2-9,15-16H,10-11H2,1H3/t15-,16-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human glycine alpha3 receptor expressed in HEK293T cells by SPR assay |
J Med Chem 60: 1105-1125 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01496
BindingDB Entry DOI: 10.7270/Q2FX7CP4 |
More data for this
Ligand-Target Pair | |
Glycine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50229714
(CHEMBL4101556)Show SMILES [H][C@]12CN(C[C@@]1([H])c1cnccc1N(C)C2=O)S(=O)(=O)c1ccc2occc2c1 |r| Show InChI InChI=1S/C19H17N3O4S/c1-21-17-4-6-20-9-14(17)15-10-22(11-16(15)19(21)23)27(24,25)13-2-3-18-12(8-13)5-7-26-18/h2-9,15-16H,10-11H2,1H3/t15-,16-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Binding affinity to human glycine alpha3 receptor expressed in HEK293T cells by SPR assay |
J Med Chem 60: 1105-1125 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01496
BindingDB Entry DOI: 10.7270/Q2FX7CP4 |
More data for this
Ligand-Target Pair | |
Glycine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50229713
(CHEMBL4081234)Show SMILES [H][C@]12CN([C@H](C)[C@@]1([H])C(=O)N(C)c1ccncc21)S(=O)(=O)c1ccc2OCOc2c1 |r| Show InChI InChI=1S/C19H19N3O5S/c1-11-18-14(13-8-20-6-5-15(13)21(2)19(18)23)9-22(11)28(24,25)12-3-4-16-17(7-12)27-10-26-16/h3-8,11,14,18H,9-10H2,1-2H3/t11-,14-,18-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | >2.50E+4 | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Positive allosteric modulation of human glycine alpha3 receptor expressed in HEK293T cells assessed as potentiation of glycine-induced increase in ch... |
J Med Chem 60: 1105-1125 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01496
BindingDB Entry DOI: 10.7270/Q2FX7CP4 |
More data for this
Ligand-Target Pair | |
Glycine receptor subunit alpha-3
(Homo sapiens (Human)) | BDBM50229715
(CHEMBL4070615)Show SMILES [H][C@]12CN([C@@H](C)[C@@]1([H])C(=O)N(C)c1ccncc21)S(=O)(=O)c1ccc2OCOc2c1 |r| Show InChI InChI=1S/C19H19N3O5S/c1-11-18-14(13-8-20-6-5-15(13)21(2)19(18)23)9-22(11)28(24,25)12-3-4-16-17(7-12)27-10-26-16/h3-8,11,14,18H,9-10H2,1-2H3/t11-,14+,18+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
PubMed
| n/a | n/a | n/a | n/a | 50 | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Positive allosteric modulation of human glycine alpha3 receptor expressed in HEK293T cells assessed as potentiation of glycine-induced increase in ch... |
J Med Chem 60: 1105-1125 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01496
BindingDB Entry DOI: 10.7270/Q2FX7CP4 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
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