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Target
Carbonic anhydrase 1
Ligand
BDBM71742
Substrate
n/a
Meas. Tech.
ChEMBL_808110 (CHEMBL1961261)
Ki
5560±n/a nM
Citation
 Carta, F; Maresca, A; Scozzafava, A; Supuran, CT Novel coumarins and 2-thioxo-coumarins as inhibitors of the tumor-associated carbonic anhydrases IX and XII. Bioorg Med Chem 20:2266-73 (2012) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 1
Synonyms:
CA-I | CA1 | CAB | CAH1_HUMAN | Carbonate dehydratase I | Carbonic anhydrase | Carbonic anhydrase 1 (CA I) | Carbonic anhydrase 1 (CA-I) | Carbonic anhydrase 1 (Recombinant CA I) | Carbonic anhydrase 2 (CA II) | Carbonic anhydrase B | Carbonic anhydrase I | Carbonic anhydrase I (CA I) | Carbonic anhydrase I (CA-I) | Carbonic anhydrase I (CAI) | Carbonic anhydrase I (hCA I) | Carbonic anhydrase isoenzyme I (hCA I) | hCA
Type:
Enzyme
Mol. Mass.:
28873.37
Organism:
Homo sapiens (Human)
Description:
P00915
Residue:
261
Sequence:
MASPDWGYDDKNGPEQWSKLYPIANGNNQSPVDIKTSETKHDTSLKPISVSYNPATAKEIINVGHSFHVNFEDNDNRSVLKGGPFSDSYRLFQFHFHWGSTNEHGSEHTVDGVKYSAELHVAHWNSAKYSSLAEAASKADGLAVIGVLMKVGEANPKLQKVLDALQAIKTKGKRAPFTNFDPSTLLPSSLDFWTYPGSLTHPPLYESVTWIICKESISVSSEQLAQFRSLLSNVEGDNAVPMQHNNRPTQPLKGRTVRASF
  
Inhibitor
Name:
BDBM71742
Synonyms:
7-amino-4-methyl-1-benzopyran-2-one | 7-amino-4-methyl-coumarin | 7-amino-4-methylchromen-2-one | 7-azanyl-4-methyl-chromen-2-one | EN300-05587 | MLS000057660 | SMR000067752 | cid_92249
Type:
Small organic molecule
Emp. Form.:
C10H9NO2
Mol. Mass.:
175.184
SMILES:
Cc1cc(=O)oc2cc(N)ccc12
Structure:
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