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Assay Detail

CHEMBL828779

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Binding
Inhibitory activity against human carbonic anhydrase I expressed in Escherichia coli BL21
24
Total Activities
24
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

Carbonic anhydrase inhibitors: synthesis and inhibition of cytosolic/tumor-associated carbonic anhydrase isozymes I, II, and IX with sulfonamides incorporating 1,2,4-triazine moieties.
Garaj V, Puccetti L, Fasolis G, Winum JY, Montero JL, Scozzafava A, Vullo D, Innocenti A, Supuran CT.
Bioorg Med Chem Lett (2004) 14 : 5427 -5433
PubMed 15454239 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 24 6.60 7.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL18 ETHOXZOLAMIDE 4.0 1 7.60
CHEMBL77517 INDISULAM 2.0 1 7.51
CHEMBL19 METHAZOLAMIDE 4.0 1 7.30
CHEMBL187274 1 7.12
CHEMBL363543 1 7.11
CHEMBL366086 1 7.09
CHEMBL186716 1 7.08
CHEMBL365860 1 7.07
CHEMBL184107 1 7.06
CHEMBL186504 1 7.05
CHEMBL185473 1 7.03
CHEMBL359997 1 7.02
CHEMBL183153 1 6.99
CHEMBL184923 1 6.98
CHEMBL183945 1 6.96
CHEMBL185549 1 6.94
CHEMBL366069 1 6.92
CHEMBL187901 1 6.87
CHEMBL20 ACETAZOLAMIDE 4.0 1 6.60
CHEMBL17 DICHLORPHENAMIDE 4.0 1 5.92
CHEMBL7087 1 4.68
CHEMBL419 MAFENIDE 4.0 1 4.60
CHEMBL21 SULFANILAMIDE 4.0 1 4.55
CHEMBL218490 DORZOLAMIDE 4.0 1 4.30

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL18 ETHOXZOLAMIDE Ki = 25.0 nM 7.60
CHEMBL77517 INDISULAM Ki = 31.0 nM 7.51
CHEMBL19 METHAZOLAMIDE Ki = 50.0 nM 7.30
CHEMBL187274 Ki = 75.0 nM 7.12
CHEMBL363543 Ki = 78.0 nM 7.11
CHEMBL366086 Ki = 82.0 nM 7.09
CHEMBL186716 Ki = 83.0 nM 7.08
CHEMBL365860 Ki = 85.0 nM 7.07
CHEMBL184107 Ki = 88.0 nM 7.06
CHEMBL186504 Ki = 90.0 nM 7.05
CHEMBL185473 Ki = 94.0 nM 7.03
CHEMBL359997 Ki = 96.0 nM 7.02
CHEMBL183153 Ki = 103.0 nM 6.99
CHEMBL184923 Ki = 105.0 nM 6.98
CHEMBL183945 Ki = 110.0 nM 6.96
CHEMBL185549 Ki = 116.0 nM 6.94
CHEMBL366069 Ki = 120.0 nM 6.92
CHEMBL187901 Ki = 136.0 nM 6.87
CHEMBL20 ACETAZOLAMIDE Ki = 250.0 nM 6.60
CHEMBL17 DICHLORPHENAMIDE Ki = 1200.0 nM 5.92
CHEMBL7087 Ki = 21000.0 nM 4.68
CHEMBL419 MAFENIDE Ki = 25000.0 nM 4.60
CHEMBL21 SULFANILAMIDE Ki = 28000.0 nM 4.55
CHEMBL218490 DORZOLAMIDE Ki = 50000.0 nM 4.30