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Assay Detail

CHEMBL3367565

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Binding
Inhibition of human recombinant Carbonic anhydrase 1 compound preincubated for 15 mins by stopped flow CO2 hydrase assay method
40
Total Activities
40
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

Sulfonamide inhibition study of the carbonic anhydrases from the bacterial pathogen Porphyromonas gingivalis: the β-class (PgiCAb) versus the γ-class (PgiCA) enzymes.
Prete SD, Vullo D, Osman SM, Scozzafava A, AlOthman Z, Capasso C, Supuran CT.
Bioorg Med Chem (2014) 22 : 4537 -4543
PubMed 25129169 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 40 5.82 8.22

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL268439 1 8.22
CHEMBL73962 BENZOLAMIDE 1 7.82
CHEMBL18 ETHOXZOLAMIDE 4.0 1 7.60
CHEMBL77517 INDISULAM 2.0 1 7.51
CHEMBL19 METHAZOLAMIDE 4.0 1 7.30
CHEMBL750 ZONISAMIDE 4.0 1 7.25
CHEMBL2324864 1 7.16
CHEMBL2324868 1 7.10
CHEMBL7146 1 7.02
CHEMBL266026 1 6.96
CHEMBL6633 1 6.96
CHEMBL269122 1 6.79
CHEMBL414 CARZENIDE 2.0 1 6.79
CHEMBL20 ACETAZOLAMIDE 4.0 1 6.60
CHEMBL220492 TOPIRAMATE 4.0 1 6.60
CHEMBL435 HYDROCHLOROTHIAZIDE 4.0 1 6.48
CHEMBL328560 SULTHIAME 3.0 1 6.43
CHEMBL26 SULPIRIDE 3.0 1 5.92
CHEMBL17 DICHLORPHENAMIDE 4.0 1 5.92
CHEMBL224292 1 5.26
CHEMBL418 2,4-DISULFAMYLTRIFLUOROMETHYLANILINE 1 5.24
CHEMBL6724 1 5.19
CHEMBL2324869 1 5.14
CHEMBL6853 1 5.08
CHEMBL266240 1 5.08
CHEMBL265674 1 5.07
CHEMBL6753 1 5.03
CHEMBL6919 1 5.02
CHEMBL7092 1 5.01
CHEMBL310671 SACCHARIN 3.0 1 4.73

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL268439 Ki = 6.0 nM 8.22
CHEMBL73962 BENZOLAMIDE Ki = 15.0 nM 7.82
CHEMBL18 ETHOXZOLAMIDE Ki = 25.0 nM 7.60
CHEMBL77517 INDISULAM Ki = 31.0 nM 7.51
CHEMBL19 METHAZOLAMIDE Ki = 50.0 nM 7.30
CHEMBL750 ZONISAMIDE Ki = 56.0 nM 7.25
CHEMBL2324864 Ki = 69.0 nM 7.16
CHEMBL2324868 Ki = 79.0 nM 7.10
CHEMBL7146 Ki = 95.0 nM 7.02
CHEMBL266026 Ki = 109.0 nM 6.96
CHEMBL6633 Ki = 109.0 nM 6.96
CHEMBL269122 Ki = 164.0 nM 6.79
CHEMBL414 CARZENIDE Ki = 164.0 nM 6.79
CHEMBL20 ACETAZOLAMIDE Ki = 250.0 nM 6.60
CHEMBL220492 TOPIRAMATE Ki = 250.0 nM 6.60
CHEMBL435 HYDROCHLOROTHIAZIDE Ki = 328.0 nM 6.48
CHEMBL328560 SULTHIAME Ki = 374.0 nM 6.43
CHEMBL26 SULPIRIDE Ki = 1200.0 nM 5.92
CHEMBL17 DICHLORPHENAMIDE Ki = 1200.0 nM 5.92
CHEMBL224292 Ki = 5500.0 nM 5.26
CHEMBL418 2,4-DISULFAMYLTRIFLUOROMETHYLANILINE Ki = 5800.0 nM 5.24
CHEMBL6724 Ki = 6500.0 nM 5.19
CHEMBL2324869 Ki = 7300.0 nM 5.14
CHEMBL6853 Ki = 8300.0 nM 5.08
CHEMBL266240 Ki = 8400.0 nM 5.08
CHEMBL265674 Ki = 8600.0 nM 5.07
CHEMBL6753 Ki = 9300.0 nM 5.03
CHEMBL6919 Ki = 9500.0 nM 5.02
CHEMBL7092 Ki = 9800.0 nM 5.01
CHEMBL310671 SACCHARIN Ki = 18540.0 nM 4.73
CHEMBL6784 Ki = 21000.0 nM 4.68
CHEMBL7087 Ki = 21000.0 nM 4.68
CHEMBL21 SULFANILAMIDE Ki = 25000.0 nM 4.60
CHEMBL419 MAFENIDE Ki = 25000.0 nM 4.60
CHEMBL6852 Ki = 28000.0 nM 4.55
CHEMBL220491 BRINZOLAMIDE Ki = 45000.0 nM 4.35
CHEMBL218490 DORZOLAMIDE Ki = 50000.0 nM 4.30
CHEMBL118 CELECOXIB Ki = 50000.0 nM 4.30
CHEMBL865 VALDECOXIB Ki = 54000.0 nM 4.27
CHEMBL574 P-TOLUENESULFONAMIDE Ki = 78500.0 nM 4.11