Reaction Details Report a problem with these data
Target
Delta carbonic anhydrase
Ligand
BDBM11639
Substrate
n/a
Meas. Tech.
ChEMBL_1282543 (CHEMBL3101210)
Ki
265±n/a nM
Citation
Vullo, D; Del Prete, S; Osman, SM; De Luca, V; Scozzafava, A; Alothman, Z; Supuran, CT; Capasso, C Sulfonamide inhibition studies of thed-carbonic anhydrase from the diatom Thalassiosira weissflogii. Bioorg Med Chem Lett 24:275-9 (2013) [PubMed] Article
More Info.:
Target
Name:
Delta carbonic anhydrase
Synonyms:
ca1
Type:
PROTEIN
Mol. Mass.:
32261.40
Organism:
Thalassiosira weissflogii
Description:
ChEMBL_107983
Residue:
281
Sequence:
MEVDVVPNTKNYWQSSMCPVNVHWHLGTEHYSVGEYDENGSGPNGNVGVPYRRTLAEGEVQDGFRCHHYDPDDEAYTRPYEWKHCIGMEVGETYEVHWPHSGAGACGTTYQYQTPFYDGVFCNLDMETLQTLAPQDIANAVGVQGQIFTIVNDDTYYYPDLIRGWIVDEEMGMGQDIAMYTGSTTGESRSNEICSSYSPITWQVDRKCHKISASSFDKLCYDMKMQRDDMSDDLYAHGSRELVTPEYVANNQQTRRLTEKHEHNHSHGHSHVRGHQHHQWF
Inhibitor
Name:
BDBM11639
Synonyms:
4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]benzene-1-sulfonamide | CHEMBL118 | CLX | Celebrex | Celecoxib | US10322118, Urea-Based Scaffold Entry 9 | US11478464, Compound Celecoxib | US11786535, Compound Celecoxib | US8741944, Comparative Compound | US9388139, Celecoxib | cid_2662
Type:
Small organic molecule
Emp. Form.:
C17H14F3N3O2S
Mol. Mass.:
381.372
SMILES:
Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F