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Assay Detail

CHEMBL827064

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Binding
Inhibitory constant against human Carbonic anhydrase I
15
Total Activities
15
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, IX, and XII with N-hydroxysulfamides--a new zinc-binding function in the design of inhibitors.
Winum JY, Innocenti A, Nasr J, Montero JL, Scozzafava A, Vullo D, Supuran CT.
Bioorg Med Chem Lett (2005) 15 : 2353 -2358
PubMed 15837324 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 15 6.25 8.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL167179 1 8.10
CHEMBL166340 1 7.70
CHEMBL169486 1 7.47
CHEMBL168910 1 7.41
CHEMBL67749 1 6.99
CHEMBL303601 1 6.43
CHEMBL68536 PERFLUOROPHENYL SULFAMATE 1 6.38
CHEMBL24119 1 6.32
CHEMBL195540 1 5.39
CHEMBL193635 1 5.24
CHEMBL195370 1 5.22
CHEMBL193396 1 5.09
CHEMBL370104 1 5.09
CHEMBL305268 METHANESULFONAMIDE 1 4.68
CHEMBL355001 SULFAMIDE 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL167179 Ki = 8.0 nM 8.10
CHEMBL166340 Ki = 20.0 nM 7.70
CHEMBL169486 Ki = 34.0 nM 7.47
CHEMBL168910 Ki = 39.0 nM 7.41
CHEMBL67749 Ki = 103.0 nM 6.99
CHEMBL303601 Ki = 369.0 nM 6.43
CHEMBL68536 PERFLUOROPHENYL SULFAMATE Ki = 415.0 nM 6.38
CHEMBL24119 Ki = 480.0 nM 6.32
CHEMBL195540 Ki = 4050.0 nM 5.39
CHEMBL193635 Ki = 5800.0 nM 5.24
CHEMBL195370 Ki = 6000.0 nM 5.22
CHEMBL193396 Ki = 8200.0 nM 5.09
CHEMBL370104 Ki = 8100.0 nM 5.09
CHEMBL305268 METHANESULFONAMIDE Ki = 21000.0 nM 4.68
CHEMBL355001 SULFAMIDE Ki = 310000.0 nM -