Ki Summary

Reaction Details

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Target

Carbonic anhydrase 2

Ligand

BDBM50031576

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1440916 (CHEMBL3375180)

43±n/a nM

Citation

Bozdag, M; Pinard, M; Carta, F; Masini, E; Scozzafava, A; McKenna, R; Supuran, CT A class of 4-sulfamoylphenyl-�-aminoalkyl ethers with effective carbonic anhydrase inhibitory action and antiglaucoma effects. J Med Chem57:9673-86 (2014) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Carbonic anhydrase 2

Name:

Carbonic anhydrase 2

Synonyms:

Type:

Enzyme

Mol. Mass.:

29250.71

Organism:

Homo sapiens (Human)

Description:

P00918

Residue:

260

Sequence:

MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRIL
NNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHL
VHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDP
RGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELM
VDNWRPAQPLKNRQIKASFK

BDBM50031576

n/a

Name

BDBM50031576

Synonyms:

CHEMBL3359178

Type

Small organic molecule

Emp. Form.

C34H36ClN5O6S2

Mol. Mass.

710.263

SMILES

[Cl-].CN(C)c1ccc2c(-c3ccc(NC(=S)NCCCOc4ccc(cc4)S(N)(=O)=O)cc3C(O)=O)c3ccc(cc3oc2c1)=[N+](C)C |(15.58,,;11.4,-1.72,;10.07,-2.49,;10.07,-4.03,;8.74,-1.72,;7.4,-2.49,;6.07,-1.72,;6.07,-.18,;4.73,.59,;3.4,-.18,;2.07,.59,;.73,-.18,;.73,-1.72,;-.6,-2.49,;-1.93,-1.72,;-1.93,-.18,;-3.27,-2.49,;-4.6,-1.72,;-5.93,-2.49,;-7.27,-1.72,;-8.6,-2.49,;-9.94,-1.72,;-9.94,-.18,;-11.27,.59,;-12.6,-.18,;-12.6,-1.72,;-11.27,-2.49,;-13.94,.59,;-13.17,1.93,;-15.27,1.36,;-14.71,-.74,;2.07,-2.49,;3.4,-1.72,;4.73,-2.49,;4.73,-4.03,;6.27,-2.65,;4.73,2.13,;3.4,2.9,;3.4,4.44,;4.73,5.21,;6.07,4.44,;6.07,2.9,;7.4,2.13,;7.4,.59,;8.74,-.18,;4.73,6.75,;6.07,7.52,;3.4,7.52,)|

Structure