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Target
Carbonic anhydrase
Ligand
BDBM50339600
Substrate
n/a
Meas. Tech.
ChEMBL_736725 (CHEMBL1695106)
Ki
860±n/a nM
Citation
 Davis, RA; Hofmann, A; Osman, A; Hall, RA; Mühlschlegel, FA; Vullo, D; Innocenti, A; Supuran, CT; Poulsen, SA Natural product-based phenols as novel probes for mycobacterial and fungal carbonic anhydrases. J Med Chem 54:1682-92 (2011) [PubMed]  Article 
Target
Name:
Carbonic anhydrase
Synonyms:
Carbonic Anhydrase 2 (Can2)
Type:
Enzyme
Mol. Mass.:
26594.37
Organism:
Cryptococcus neoformans var. grubii (Filobasidiella neoformans var. grubii)
Description:
n/a
Residue:
239
Sequence:
MPFHAEPLKPSDEIDMDLGHSVAAQKFKEIREVLEGNRYWARKVTSEEPEFMAEQVKGQAPNFLWIGCADSRVPEVTIMARKPGDVFVQRNVANQFKPEDDSSQALLNYAIMNVGVTHVMVVGHTGCGGCIAAFDQPLPTEENPGGTPLVRYLEPIIRLKHSLPEGSDVNDLIKENVKMAVKNVVNSPTIQGAWEQARKGEFREVFVHGWLYDLSTGNIVDLNVTQGPHPFVDDRVPRA
  
Inhibitor
Name:
BDBM50339600
Synonyms:
2-(3-chloro-4-hydroxyphenyl)-N-(3,4-dimethoxyphenethyl)acetamide | CHEMBL589604
Type:
Small organic molecule
Emp. Form.:
C18H20ClNO4
Mol. Mass.:
349.809
SMILES:
COc1ccc(CCNC(=O)Cc2ccc(O)c(Cl)c2)cc1OC
Structure:
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