Reaction Details Report a problem with these data
Target
Carbonic anhydrase 1
Ligand
BDBM246515
Substrate
BDBM246520
Meas. Tech.
Hydratase and Esterase Activity Assays
Ki
1.73e+5± 4.77e+4 nM
Citation
 Akbaba, Y; Akincioglu, A; Göçer, H; Göksu, S; Gülçin, I; Supuran, CT Carbonic anhydrase inhibitory properties of novel sulfonamide derivatives of aminoindanes and aminotetralins. J Enzyme Inhib Med Chem 29:35-42 (2014) [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:
BDBM246515
Synonyms:
N-(Indane-1-yl)methanesulfonamide (29)
Type:
Small organic molecule
Emp. Form.:
C10H13NO2S
Mol. Mass.:
211.281
SMILES:
CS(=O)(=O)NC1CCc2ccccc12
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
BDBM246520
Synonyms:
4-Nitrophenylacetate
Type:
Small organic molecule
Emp. Form.:
C8H6NO4
Mol. Mass.:
180.1381
SMILES:
[O-]C(=O)Cc1ccc(cc1)[N+]([O-])=O
Structure:
Search PDB for entries with ligand similarity: