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Assay Detail

CHEMBL950886

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of human recombinant cytosolic carbonic anhydrase 1 preincubated for 15 mins by CO2 hydration stopped-flow assay
17
Total Activities
17
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Intermediate

Target

Carbonic anhydrase 1 (CHEMBL261)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Carbonic anhydrase inhibitors. Inhibition of the fungal beta-carbonic anhydrases from Candida albicans and Cryptococcus neoformans with boronic acids.
Innocenti A, Winum JY, Hall RA, Mühlschlegel FA, Scozzafava A, Supuran CT.
Bioorg Med Chem Lett (2009) 19 : 2642 -2645
PubMed 19375309 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 17 5.38 7.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL18 ETHOXZOLAMIDE 4.0 1 7.60
CHEMBL20 ACETAZOLAMIDE 4.0 1 6.60
CHEMBL17 DICHLORPHENAMIDE 4.0 1 5.92
CHEMBL485742 BIPHENYLBORONIC ACID 1 5.43
CHEMBL459151 1 5.22
CHEMBL141079 1 5.19
CHEMBL555064 1 5.10
CHEMBL539140 1 5.07
CHEMBL561852 1 5.02
CHEMBL453758 1 4.97
CHEMBL21427 1 4.96
CHEMBL20461 PHENETHYLBORONIC ACID 1 4.94
CHEMBL20866 1 4.93
CHEMBL551649 1 4.92
CHEMBL559289 STYRYLBORONIC ACID 1 4.90
CHEMBL21485 PHENYLBORONIC ACID 1 -
CHEMBL140780 TOLYL BORONIC ACID 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL18 ETHOXZOLAMIDE Ki = 25.0 nM 7.60
CHEMBL20 ACETAZOLAMIDE Ki = 250.0 nM 6.60
CHEMBL17 DICHLORPHENAMIDE Ki = 1200.0 nM 5.92
CHEMBL485742 BIPHENYLBORONIC ACID Ki = 3700.0 nM 5.43
CHEMBL459151 Ki = 6000.0 nM 5.22
CHEMBL141079 Ki = 6500.0 nM 5.19
CHEMBL555064 Ki = 7900.0 nM 5.10
CHEMBL539140 Ki = 8600.0 nM 5.07
CHEMBL561852 Ki = 9500.0 nM 5.02
CHEMBL453758 Ki = 10700.0 nM 4.97
CHEMBL21427 Ki = 10900.0 nM 4.96
CHEMBL20461 PHENETHYLBORONIC ACID Ki = 11400.0 nM 4.94
CHEMBL20866 Ki = 11700.0 nM 4.93
CHEMBL551649 Ki = 12100.0 nM 4.92
CHEMBL559289 STYRYLBORONIC ACID Ki = 12500.0 nM 4.90
CHEMBL21485 PHENYLBORONIC ACID Ki = 1560000.0 nM -
CHEMBL140780 TOLYL BORONIC ACID Ki = 278000.0 nM -