Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetCarbonic anhydrase 4
LigandBDBM50317413
Substrate/Competitorn/a
Meas. Tech.ChEMBL_631615 (CHEMBL1106609)
IC50 402±n/a nM
Citation Vernier, WChong, WRewolinski, DGreasley, SPauly, TShaw, MDinh, DFerre, RAMeador, JWNukui, SOrnelas, MPaz, RLReyner, E Thioether benzenesulfonamide inhibitors of carbonic anhydrases II and IV: structure-based drug design, synthesis, and biological evaluation. Bioorg Med Chem18:3307-19 (2010) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Carbonic anhydrase 4
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:
MRMLLALLALSAARPSASAESHWCYEVQAESSNYPCLVPVKWGGNCQKDRQSPINIVTTK
AKVDKKLGRFFFSGYDKKQTWTVQNNGHSVMMLLENKASISGGGLPAPYQAKQLHLHWSD
LPYKGSEHSLDGEHFAMEMHIVHEKEKGTSRNVKEAQDPEDEIAVLAFLVEAGTQVNEGF
QPLVEALSNIPKPEMSTTMAESSLLDLLPKEEKLRHYFRYLGSLTTPTCDEKVVWTVFRE
PIQLHREQILAFSQKLYYDKEQTVSMKDNVRPLQQLGQRTVIKSGAPGRPLPWALPALLG
PMLACLLAGFLR
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50317413
n/a
NameBDBM50317413
Synonyms:6-[(3,4-Difluorophenyl)thio]-5-{[(4-methoxybenzyl)-amino]methyl}pyridine-3-sulfonamide | CHEMBL1095855
TypeSmall organic molecule
Emp. Form.C20H19F2N3O3S2
Mol. Mass.451.51
SMILESCOc1ccc(CNCc2cc(cnc2Sc2ccc(F)c(F)c2)S(N)(=O)=O)cc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: