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Target
Carbonic anhydrase 9
Ligand
BDBM50609173
Substrate
n/a
Meas. Tech.
ChEMBL_2277036
Ki
4.7±n/a nM
Citation
 Chuai, H; Zhang, SQ; Bai, H; Li, J; Wang, Y; Sun, J; Wen, E; Zhang, J; Xin, M Small molecule selenium-containing compounds: Recent development and therapeutic applications. Eur J Med Chem 223:0 (2021) [PubMed] 
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:
BDBM50609173
Synonyms:
CHEMBL5277717
Type:
Small organic molecule
Emp. Form.:
C16H18N2O3SSe
Mol. Mass.:
397.35
SMILES:
[#7]S(=O)(=O)c1ccc(-[#6]-[#6]-[#7]-[#6](=O)-[#6][Se;v2]c2ccccc2)cc1
Structure:
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