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Assay Detail

CHEMBL3095666

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

Binding
Inhibition of human recombinant carbonic anhydrase 2-mediated CO2 hydration preincubated for 15 mins by stopped-flow assay
16
Total Activities
16
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 2 (CHEMBL205)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Salen and tetrahydrosalen derivatives act as effective inhibitors of the tumor-associated carbonic anhydrase XII--a new scaffold for designing isoform-selective inhibitors.
Carradori S, De Monte C, D'Ascenzio M, Secci D, Celik G, Ceruso M, Vullo D, Scozzafava A, Supuran CT.
Bioorg Med Chem Lett (2013) 23 : 6759 -6763
PubMed 24189056 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 16 5.86 7.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL20 ACETAZOLAMIDE 4.0 1 7.92
CHEMBL3092749 1 6.62
CHEMBL3092750 1 6.51
CHEMBL1467754 1 6.41
CHEMBL594100 N,N'-DISALICYLALETHYLENEDIAMINE 1 5.76
CHEMBL3092751 1 5.50
CHEMBL3092748 1 5.47
CHEMBL1985188 1 5.47
CHEMBL3092747 1 5.45
CHEMBL1163022 1 5.44
CHEMBL256208 1 5.43
CHEMBL593618 1 5.41
CHEMBL593165 1 5.38
CHEMBL14060 PHENOL 4.0 1 5.26
CHEMBL3092746 1 -
CHEMBL3092752 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL20 ACETAZOLAMIDE Ki = 12.0 nM 7.92
CHEMBL3092749 Ki = 240.0 nM 6.62
CHEMBL3092750 Ki = 310.0 nM 6.51
CHEMBL1467754 Ki = 390.0 nM 6.41
CHEMBL594100 N,N'-DISALICYLALETHYLENEDIAMINE Ki = 1720.0 nM 5.76
CHEMBL3092751 Ki = 3130.0 nM 5.50
CHEMBL3092748 Ki = 3390.0 nM 5.47
CHEMBL1985188 Ki = 3420.0 nM 5.47
CHEMBL3092747 Ki = 3530.0 nM 5.45
CHEMBL1163022 Ki = 3600.0 nM 5.44
CHEMBL256208 Ki = 3690.0 nM 5.43
CHEMBL593618 Ki = 3920.0 nM 5.41
CHEMBL593165 Ki = 4190.0 nM 5.38
CHEMBL14060 PHENOL Ki = 5500.0 nM 5.26
CHEMBL3092746 Ki > 100000.0 nM -
CHEMBL3092752 Ki > 100000.0 nM -