Target
Carbonic anhydrase
Ligand
BDBM50339604
Substrate
n/a
Meas. Tech.
ChEMBL_736725 (CHEMBL1695106)
Ki
730±n/a nM
Citation
 Davis, RAHofmann, AOsman, AHall, RAMühlschlegel, FAVullo, DInnocenti, ASupuran, CTPoulsen, 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:
BDBM50339604
Synonyms:
CHEMBL605189 | N-butyl-2-(3-chloro-4-hydroxyphenyl)acetamide
Type:
Small organic molecule
Emp. Form.:
C12H16ClNO2
Mol. Mass.:
241.714
SMILES:
CCCCNC(=O)Cc1ccc(O)c(Cl)c1
Structure:
Search PDB for entries with ligand similarity: