Target
Sodium- and chloride-dependent GABA transporter 1
Ligand
BDBM50039251
Substrate
n/a
Meas. Tech.
ChEMBL_306675 (CHEMBL830009)
IC50
1780±n/a nM
Citation
 Héja, LKovács, ISzárics, EIncze, MTemesváriné-Major, EDörnyei, GPeredy-Kajtár, MGács-Baitz, ESzántay, CKardos, J Novel secoergoline derivatives inhibit both GABA and glutamate uptake in rat brain homogenates: synthesis, in vitro pharmacology, and modeling. J Med Chem 47:5620-9 (2004) [PubMed]  Article 
Target
Name:
Sodium- and chloride-dependent GABA transporter 1
Synonyms:
GABA transporter | Solute carrier family 6 member 1 | SC6A1_RAT | Slc6a1 | Gabt1 | Gat-1 | Gat1
Type:
PROTEIN
Mol. Mass.:
67006.26
Organism:
Rat
Description:
ChEMBL_1472611
Residue:
599
Sequence:
MATDNSKVADGQISTEVSEAPVASDKPKTLVVKVQKKAGDLPDRDTWKGRFDFLMSCVGYAIGLGNVWRFPYLCGKNGGGAFLIPYFLTLIFAGVPLFLLECSLGQYTSIGGLGVWKLAPMFKGVGLAAAVLSFWLNIYYIVIISWAIYYLYNSFTTTLPWKQCDNPWNTDRCFSNYSLVNTTNMTSAVVEFWERNMHQMTDGLDKPGQIRWPLAITLAIAWVLVYFCIWKGVGWTGKVVYFSATYPYIMLIILFFRGVTLPGAKEGILFYITPNFRKLSDSEVWLDAATQIFFSYGLGLGSLIALGSYNSFHNNVYRDSIIVCCINSCTSMFAGFVIFSIVGFMAHVTKRSIADVAASGPGLAFLAYPEAVTQLPISPLWAILFFSMLLMLGIDSQFCTVEGFITALVDEYPRLLRNRRELFIAAVCIVSYLIGLSNITQGGIYVFKLFDYYSASGMSLLFLVFFECVSISWFYGVNRFYDNIQEMVGSRPCIWWKLCWSFFTPIIVAGVFLFSAVQMTPLTMGSYVFPKWGQGVGWLMALSSMVLIPGYMAYMFLTLKGSLKQRLQVMIQPSEDIVRPENGPEQPQAGSSASKEAYI
  
Inhibitor
Name:
BDBM50039251
Synonyms:
CHEMBL1027 | Gabitril | 1-[4,4-Bis-(3-methyl-4,5-dihydro-thiophen-2-yl)-but-3-enyl]-piperidine-3-carboxylic acid | ABBOTT-70569 | A-70569-1 | ABBOTT-70569-1 | NNC-05-0328 | NO-05-0328 | (R)-1-(4,4-bis(3-methylthiophen-2-yl)but-3-enyl)piperidine-3-carboxylic acid hydrochloride | (R)-1-[4,4-Bis-(3-methyl-thiophen-2-yl)-but-3-enyl]-piperidine-3-carboxylic acid | Tiagabine hydrochloride | (R)-1-[4,4-Bis-(3-methyl-thiophen-2-yl)-but-3-enyl]-piperidine-3-carboxylic acid; hydrochloride | (S)-1-(4,4-bis(3-methylthiophen-2-yl)but-3-enyl)piperidine-3-carboxylic acid | ABT-569 | 1-[4,4-Bis-(3-methyl-thiophen-2-yl)-but-3-enyl]-piperidine-3-carboxylic acid; hydrochloride | TIAGABINE
Type:
Small organic molecule
Emp. Form.:
C20H5NO2S2
Mol. Mass.:
355.40
SMILES:
[C]c1ccsc1C(=[C][C][C]N1[C][C][C][C@@H](C([O])=O)[C]1)c1sccc1[C] |^1:7,16,^2:8,9,11,12,13,18,^5:0,24|
Structure:
Search PDB for entries with ligand similarity: