Reaction Details Report a problem with these data
Target
Xylosyl- and glucuronyltransferase LARGE1
Ligand
BDBM94733
Substrate
n/a
EC50
1900±n/a nM
Citation
 PubChem, PC Dose response confirmation of small molecule activators of alpha dystroglycan glycosylation PubChem Bioassay (2012)[AID] 
Target
Name:
Xylosyl- and glucuronyltransferase LARGE1
Synonyms:
KIAA0609 | LARG1_HUMAN | LARGE | LARGE1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
88079.63
Organism:
Homo sapiens (Human)
Description:
gi_47678551
Residue:
756
Sequence:
MLGICRGRRKFLAASLSLLCIPAITWIYLFSGSFEDGKPVSLSPLESQAHSPRYTASSQRERESLEVRMREVEEENRALRRQLSLAQGRAPSHRRGNHSKTYSMEEGTGDSENLRAGIVAGNSSECGQQPVVEKCETIHVAIVCAGYNASRDVVTLVKSVLFHRRNPLHFHLIADSIAEQILATLFQTWMVPAVRVDFYNADELKSEVSWIPNKHYSGIYGLMKLVLTKTLPANLERVIVLDTDITFATDIAELWAVFHKFKGQQVLGLVENQSDWYLGNLWKNHRPWPALGRGYNTGVILLLLDKLRKMKWEQMWRLTAERELMGMLSTSLADQDIFNAVIKQNPFLVYQLPCFWNVQLSDHTRSEQCYRDVSDLKVIHWNSPKKLRVKNKHVEFFRNLYLTFLEYDGNLLRRELFGCPSEADVNSENLQKQLSELDEDDLCYEFRRERFTVHRTHLYFLHYEYEPAADSTDVTLVAQLSMDRLQMLEAICKHWEGPISLALYLSDAEAQQFLRYAQGSEVLMSRHNVGYHIVYKEGQFYPVNLLRNVAMKHISTPYMFLSDIDFLPMYGLYEYLRKSVIQLDLANTKKAMIVPAFETLRYRLSFPKSKAELLSMLDMGTLFTFRYHVWTKGHAPTNFAKWRTATTPYRVEWEADFEPYVVVRRDCPEYDRRFVGFGWNKVAHIMELDVQEYEFIVLPNAYMIHMPHAPSFDITKFRSNKQYRICLKTLKEEFQQDMSRRYGFAALKYLTAENNS
  
Inhibitor
Name:
BDBM94733
Synonyms:
MLS001061376 | N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-(2-fluorophenyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide | N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-(2-fluorophenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide | N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-3-(2-fluorophenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide | SMR000384994 | cid_4969557
Type:
Small organic molecule
Emp. Form.:
C27H27FN4O2S
Mol. Mass.:
490.592
SMILES:
CCc1ccc(cc1)C(CNC(=O)c1ccc2c(c1)[nH]c(=S)n(-c1ccccc1F)c2=O)N(C)C |(24.51,-3.12,;23.18,-3.89,;21.85,-3.11,;20.51,-3.88,;19.18,-3.1,;19.19,-1.56,;20.52,-.8,;21.85,-1.57,;17.86,-.79,;16.52,-1.55,;15.19,-.78,;13.85,-1.54,;13.85,-3.08,;12.52,-.77,;12.52,.84,;11.13,1.63,;9.75,.81,;9.75,-.73,;11.13,-1.56,;8.41,-1.5,;7.08,-.73,;5.75,-1.5,;7.08,.81,;5.75,1.58,;4.41,.81,;3.08,1.58,;3.08,3.12,;4.41,3.89,;5.75,3.12,;7.08,3.89,;8.41,1.58,;8.41,3.12,;17.86,.75,;19.2,1.52,;16.53,1.53,)|
Structure:
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