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Target
Carbonic anhydrase 9
Ligand
BDBM50467994
Substrate
n/a
Meas. Tech.
ChEMBL_1797535 (CHEMBL4269652)
Ki
3430±n/a nM
Citation
 Meleddu, R; Distinto, S; Cottiglia, F; Angius, R; Gaspari, M; Taverna, D; Melis, C; Angeli, A; Bianco, G; Deplano, S; Fois, B; Del Prete, S; Capasso, C; Alcaro, S; Ortuso, F; Yanez, M; Supuran, CT; Maccioni, E Tuning the Dual Inhibition of Carbonic Anhydrase and Cyclooxygenase by Dihydrothiazole Benzensulfonamides. ACS Med Chem Lett 9:1045-1050 (2018) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 9
Synonyms:
CA-IX | CA9 | CAH9_HUMAN | Carbonate dehydratase IX | Carbonic anhydrase 9 (CA IX) | Carbonic anhydrase 9 (CAIX) | Carbonic anhydrase 9 precursor | Carbonic anhydrase IX (CA IX) | Carbonic anhydrase IX (CAIX) | Carbonic anhydrases IX | Carbonic anhydrases; II & IX | G250 | MN | Membrane antigen MN | RCC-associated antigen G250
Type:
Enzyme
Mol. Mass.:
49669.03
Organism:
Homo sapiens (Human)
Description:
Catalytic domain of human cloned isozyme was used in the assay
Residue:
459
Sequence:
MAPLCPSPWLPLLIPAPAPGLTVQLLLSLLLLVPVHPQRLPRMQEDSPLGGGSSGEDDPLGEEDLPSEEDSPREEDPPGEEDLPGEEDLPGEEDLPEVKPKSEEEGSLKLEDLPTVEAPGDPQEPQNNAHRDKEGDDQSHWRYGGDPPWPRVSPACAGRFQSPVDIRPQLAAFCPALRPLELLGFQLPPLPELRLRNNGHSVQLTLPPGLEMALGPGREYRALQLHLHWGAAGRPGSEHTVEGHRFPAEIHVVHLSTAFARVDEALGRPGGLAVLAAFLEEGPEENSAYEQLLSRLEEIAEEGSETQVPGLDISALLPSDFSRYFQYEGSLTTPPCAQGVIWTVFNQTVMLSAKQLHTLSDTLWGPGDSRLQLNFRATQPLNGRVIEASFPAGVDSSPRAAEPVQLNSCLAAGDILALVFGLLFAVTSVAFLVQMRRQHRRGTKGGVSYRPAEVAETGA
  
Inhibitor
Name:
BDBM50467994
Synonyms:
CHEMBL4279217
Type:
Small organic molecule
Emp. Form.:
C19H15N3O2S3
Mol. Mass.:
413.536
SMILES:
NS(=O)(=O)c1ccc(cc1)\N=c1/scc(-c2cccs2)n1-c1ccccc1
Structure:
Search PDB for entries with ligand similarity: