Found 3 hits of Enzyme Inhibition Constant Data 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 |
Sodium- and chloride-dependent GABA transporter 1
(Homo sapiens (Human)) | BDBM50437144
(CHEMBL1190271)Show SMILES OC(=O)[C@@H]1CCCN(CCOCCN2c3ccccc3Sc3ccccc23)C1 |r| Show InChI InChI=1S/C22H26N2O3S/c25-22(26)17-6-5-11-23(16-17)12-14-27-15-13-24-18-7-1-3-9-20(18)28-21-10-4-2-8-19(21)24/h1-4,7-10,17H,5-6,11-16H2,(H,25,26)/t17-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 309 | n/a | n/a | n/a | n/a | n/a | n/a |
Zentrum f£r Pharmaforschung
Curated by ChEMBL
| Assay Description Inhibition of GABA uptake at GAT-1 (unknown origin) |
Eur J Med Chem 65: 487-99 (2013)
Article DOI: 10.1016/j.ejmech.2013.04.063 BindingDB Entry DOI: 10.7270/Q20V8F5W |
More data for this Ligand-Target Pair | |
Sodium- and chloride-dependent GABA transporter 1
(Homo sapiens (Human)) | BDBM50437145
(CHEMBL1196076)Show SMILES OC(=O)[C@@H]1CCCN(CCOCCN2c3ccccc3C=Cc3ccccc23)C1 |r,c:21| Show InChI InChI=1S/C24H28N2O3/c27-24(28)21-8-5-13-25(18-21)14-16-29-17-15-26-22-9-3-1-6-19(22)11-12-20-7-2-4-10-23(20)26/h1-4,6-7,9-12,21H,5,8,13-18H2,(H,27,28)/t21-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 646 | n/a | n/a | n/a | n/a | n/a | n/a |
Zentrum f£r Pharmaforschung
Curated by ChEMBL
| Assay Description Inhibition of GABA uptake at GAT-1 (unknown origin) |
Eur J Med Chem 65: 487-99 (2013)
Article DOI: 10.1016/j.ejmech.2013.04.063 BindingDB Entry DOI: 10.7270/Q20V8F5W |
More data for this Ligand-Target Pair | |
Sodium- and chloride-dependent GABA transporter 1
(Homo sapiens (Human)) | BDBM50437146
(CHEMBL1189315)Show SMILES OC(=O)[C@@H]1CCCN(CCOCCN2c3ccccc3CCc3ccccc23)C1 |r| Show InChI InChI=1S/C24H30N2O3/c27-24(28)21-8-5-13-25(18-21)14-16-29-17-15-26-22-9-3-1-6-19(22)11-12-20-7-2-4-10-23(20)26/h1-4,6-7,9-10,21H,5,8,11-18H2,(H,27,28)/t21-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.98E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Zentrum f£r Pharmaforschung
Curated by ChEMBL
| Assay Description Inhibition of GABA uptake at GAT-1 (unknown origin) |
Eur J Med Chem 65: 487-99 (2013)
Article DOI: 10.1016/j.ejmech.2013.04.063 BindingDB Entry DOI: 10.7270/Q20V8F5W |
More data for this Ligand-Target Pair | |