Reaction Details Report a problem with these data
Target
Carbonic anhydrase 4
Ligand
BDBM50230940
Substrate
n/a
Meas. Tech.
ChEMBL_1644987 (CHEMBL3993916)
Ki
16±n/a nM
Citation
 Eldehna, WM; Al-Ansary, GH; Bua, S; Nocentini, A; Gratteri, P; Altoukhy, A; Ghabbour, H; Ahmed, HY; Supuran, CT Novel indolin-2-one-based sulfonamides as carbonic anhydrase inhibitors: Synthesis, in vitro biological evaluation against carbonic anhydrases isoforms I, II, IV and VII and molecular docking studies. Eur J Med Chem 127:521-530 (2017) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 4
Synonyms:
CA-IV | CA4 | CAH4_HUMAN | Carbonate dehydratase IV | Carbonic anhydrase | Carbonic anhydrase 4 (CA IV) | Carbonic anhydrase IV (CA IV)
Type:
Enzyme
Mol. Mass.:
35037.98
Organism:
Homo sapiens (Human)
Description:
P22748
Residue:
312
Sequence:
MRMLLALLALSAARPSASAESHWCYEVQAESSNYPCLVPVKWGGNCQKDRQSPINIVTTKAKVDKKLGRFFFSGYDKKQTWTVQNNGHSVMMLLENKASISGGGLPAPYQAKQLHLHWSDLPYKGSEHSLDGEHFAMEMHIVHEKEKGTSRNVKEAQDPEDEIAVLAFLVEAGTQVNEGFQPLVEALSNIPKPEMSTTMAESSLLDLLPKEEKLRHYFRYLGSLTTPTCDEKVVWTVFREPIQLHREQILAFSQKLYYDKEQTVSMKDNVRPLQQLGQRTVIKSGAPGRPLPWALPALLGPMLACLLAGFLR
  
Inhibitor
Name:
BDBM50230940
Synonyms:
CHEMBL4069845
Type:
Small organic molecule
Emp. Form.:
C17H17N3O3S
Mol. Mass.:
343.4
SMILES:
CN1C(=O)\C(=N/CCc2ccc(cc2)S(N)(=O)=O)c2ccccc12
Structure:
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