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Assay Detail

CHEMBL2339342

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Binding
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by CO2 hydration stopped-flow assay
23
Total Activities
23
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

Inhibition pattern of sulfamide-related compounds in binding to carbonic anhydrase isoforms I, II, VII, XII and XIV.
Gavernet L, Gonzalez Funes JL, Palestro PH, Bruno Blanch LE, Estiu GL, Maresca A, Barrios I, Supuran CT.
Bioorg Med Chem (2013) 21 : 1410 -1418
PubMed 23266178 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 23 5.14 6.89

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL168526 1 6.89
CHEMBL2335233 1 5.53
CHEMBL2335232 HEXYL SULFAMATE 1 5.44
CHEMBL229740 1 5.33
CHEMBL388325 1 5.18
CHEMBL229137 BUTYL(BUTYLSULFAMOYL)AMINE 1 5.18
CHEMBL375030 1 5.16
CHEMBL229904 1 5.05
CHEMBL441884 1 5.03
CHEMBL229954 1 4.60
CHEMBL511132 1 4.21
CHEMBL466083 1 4.05
CHEMBL199831 1 -
CHEMBL2335234 1 -
CHEMBL450699 1 -
CHEMBL229190 BENZYL(BENZYLSULFAMOYL)AMINE 1 -
CHEMBL1630902 1 -
CHEMBL501961 1 -
CHEMBL471637 1 -
CHEMBL229189 1 -
CHEMBL388326 1 -
CHEMBL229902 1 -
CHEMBL461137 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL168526 Ki = 130.0 nM 6.89
CHEMBL2335233 Ki = 2980.0 nM 5.53
CHEMBL2335232 HEXYL SULFAMATE Ki = 3660.0 nM 5.44
CHEMBL229740 Ki = 4690.0 nM 5.33
CHEMBL388325 Ki = 6640.0 nM 5.18
CHEMBL229137 BUTYL(BUTYLSULFAMOYL)AMINE Ki = 6640.0 nM 5.18
CHEMBL375030 Ki = 6880.0 nM 5.16
CHEMBL229904 Ki = 8840.0 nM 5.05
CHEMBL441884 Ki = 9350.0 nM 5.03
CHEMBL229954 Ki = 24900.0 nM 4.60
CHEMBL511132 Ki = 62200.0 nM 4.21
CHEMBL466083 Ki = 88700.0 nM 4.05
CHEMBL199831 Ki > 200000.0 nM -
CHEMBL2335234 Ki > 200000.0 nM -
CHEMBL450699 Ki > 200000.0 nM -
CHEMBL229190 BENZYL(BENZYLSULFAMOYL)AMINE Ki > 200000.0 nM -
CHEMBL1630902 Ki > 200000.0 nM -
CHEMBL501961 Ki > 200000.0 nM -
CHEMBL471637 Ki > 200000.0 nM -
CHEMBL229189 Ki > 200000.0 nM -
CHEMBL388326 Ki > 200000.0 nM -
CHEMBL229902 Ki > 200000.0 nM -
CHEMBL461137 Ki > 200000.0 nM -