Ki Summary

Reaction Details

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Target

Carbonic anhydrase 14

Ligand

BDBM50500057

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1541759 (CHEMBL3745441)

31±n/a nM

Citation

Carta, F; Ferraroni, M; Scozzafava, A; Supuran, CT Fluorescent sulfonamide carbonic anhydrase inhibitors incorporating 1,2,3-triazole moieties: Kinetic and X-ray crystallographic studies. Bioorg Med Chem24:104-12 (2016) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Carbonic anhydrase 14

Name:

Carbonic anhydrase 14

Synonyms:

Type:

Enzyme

Mol. Mass.:

37665.67

Organism:

Homo sapiens (Human)

Description:

Human (cloned) isozyme.

Residue:

337

Sequence:

MLFSALLLEVIWILAADGGQHWTYEGPHGQDHWPASYPECGNNAQSPIDIQTDSVTFDPD
LPALQPHGYDQPGTEPLDLHNNGHTVQLSLPSTLYLGGLPRKYVAAQLHLHWGQKGSPGG
SEHQINSEATFAELHIVHYDSDSYDSLSEAAERPQGLAVLGILIEVGETKNIAYEHILSH
LHEVRHKDQKTSVPPFNLRELLPKQLGQYFRYNGSLTTPPCYQSVLWTVFYRRSQISMEQ
LEKLQGTLFSTEEEPSKLLVQNYRALQPLNQRMVFASFIQAGSSYTTGEMLSLGVGILVG
CLCLLLAVYFIARKIRKKRLENRKSVVFTSAQATTEA

BDBM50500057

n/a

Name

BDBM50500057

Synonyms:

CHEMBL3740484

Type

Small organic molecule

Emp. Form.

C34H33ClN8O5S2

Mol. Mass.

733.259

SMILES

[Cl-].CN(C)c1ccc2c(-c3ccc(NC(=S)NCc4cn(nn4)-c4cccc(c4)S(N)(=O)=O)cc3C(O)=O)c3ccc(cc3oc2c1)=[N+](C)C |(9.24,9.1,;-5.33,-2.78,;-5.33,-1.54,;-6.4,-.93,;-4,-.77,;-4,.77,;-2.67,1.54,;-1.33,.77,;,1.54,;0,3.08,;-1.33,3.85,;-1.33,5.39,;0,6.16,;-0,7.7,;-1.34,8.47,;-2.4,7.85,;-1.34,10.01,;-2.68,10.78,;-2.68,12.32,;-3.93,13.2,;-3.45,14.67,;-1.91,14.67,;-1.44,13.2,;-4.36,15.91,;-5.9,15.86,;-6.7,17.17,;-5.98,18.53,;-4.44,18.58,;-3.63,17.27,;-3.71,19.93,;-3.12,21.02,;-4.35,20.98,;-2.47,19.97,;1.34,5.39,;1.34,3.85,;2.67,3.09,;2.68,2.06,;3.74,3.7,;1.31,.77,;2.67,1.54,;4,.77,;4,-.77,;2.67,-1.54,;1.31,-.77,;,-1.54,;-1.33,-.77,;-2.67,-1.54,;5.34,-1.54,;5.34,-2.77,;6.4,-.92,)|

Structure