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Target
Lanosterol 14a-demethylase
Ligand
BDBM25817
Substrate
n/a
Meas. Tech.
ChEMBL_724288 (CHEMBL1677681)
Kd
4030±n/a nM
Citation
 Warrilow, AG; Melo, N; Martel, CM; Parker, JE; Nes, WD; Kelly, SL; Kelly, DE Expression, purification, and characterization of Aspergillus fumigatus sterol 14-alpha demethylase (CYP51) isoenzymes A and B. Antimicrob Agents Chemother 54:4225-34 (2010) [PubMed]  Article 
Target
Name:
Lanosterol 14a-demethylase
Synonyms:
14-alpha sterol demethylase
Type:
PROTEIN
Mol. Mass.:
58939.22
Organism:
Neosartorya fumigata
Description:
ChEMBL_724288
Residue:
524
Sequence:
MGLIAFILDGICKHCSTQSTWVLVGIGLLSILAVSVIINVLQQLLFKNPHEPPVVFHWFPFIGSTISYGIDPYKFFFDCRAKYGDIFTFILLGKKTTVYLGTKGNDFILNGKLRDVCAEEVYSPLTTPVFGRHVVYDCPNAKLMEQKKFVKYGLTSDALRSYVPLITDEVESFVKNSPAFQGHKGVFDVCKTIAEITIYTASRSLQGKEVRSKFDSTFAELYHNLDMGFAPINFMLPWAPLPHNRKRDAAQRKLTETYMEIIKARRQAGSKKDSEDMVWNLMSCVYKNGTPVPDEEIAHMMIALLMAGQHSSSSTASWIVLRLATRPDIMEELYQEQIRVLGSDLPPLTYDNLQKLDLHAKVIKETLRLHAPIHSIIRAVKNPMAVDGTSYVIPTSHNVLSSPGVTARSEEHFPNPLEWNPHRWDENIAASAEDDEKVDYGYGLVSKGTNSPYLPFGAGRHRCIGEQFAYLQLGTITAVLVRLFRFRNLPGVDGIPDTDYSSLFSKPLGRSFVEFEKRESATKA
  
Inhibitor
Name:
BDBM25817
Synonyms:
2-(2,4-difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol | CHEMBL106 | Diflucan | Fluconazole | Fluconazole (f) | Fungata | Triflucan | US10221160, Fluconazole | US11247981, Example Fluconazole | US9138393, Fluconazole | US9144538, Fluconazole | US9221791, Fluconazole | US9556143, Fluconazole | cid_3365
Type:
Small organic molecule
Emp. Form.:
C13H12F2N6O
Mol. Mass.:
306.2708
SMILES:
OC(Cn1cncn1)(Cn1cncn1)c1ccc(F)cc1F
Structure:
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