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Assay Detail

CHEMBL4145113

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

Binding
Inhibition of recombinant human carbonic anhydrase 9 incubated for 15 mins prior to testing by stopped flow CO2 hydrase assay
20
Total Activities
20
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 9 (CHEMBL3594)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of β-Adrenergic Receptors Blocker-Carbonic Anhydrase Inhibitor Hybrids for Multitargeted Antiglaucoma Therapy.
Nocentini A, Ceruso M, Bua S, Lomelino CL, Andring JT, McKenna R, Lanzi C, Sgambellone S, Pecori R, Matucci R, Filippi L, Gratteri P, Carta F, Masini E, Selleri S, Supuran CT.
J Med Chem (2018) 61 : 5380 -5394
PubMed 29851481 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 20 7.50 8.77

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4174691 1 8.77
CHEMBL4167532 1 8.24
CHEMBL4170908 1 8.22
CHEMBL4175397 1 8.15
CHEMBL4159562 1 8.13
CHEMBL4167473 1 7.66
CHEMBL4160295 1 7.63
CHEMBL20 ACETAZOLAMIDE 4.0 1 7.60
CHEMBL4174345 1 7.32
CHEMBL218490 DORZOLAMIDE 4.0 1 7.28
CHEMBL4162920 1 7.27
CHEMBL4162590 1 7.23
CHEMBL4170860 1 7.21
CHEMBL4166379 1 7.13
CHEMBL4174295 1 7.08
CHEMBL4170519 1 7.07
CHEMBL4170536 1 7.03
CHEMBL4161638 1 7.02
CHEMBL4163665 1 6.97
CHEMBL4173735 1 6.90

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4174691 Ki = 1.7 nM 8.77
CHEMBL4167532 Ki = 5.8 nM 8.24
CHEMBL4170908 Ki = 6.0 nM 8.22
CHEMBL4175397 Ki = 7.0 nM 8.15
CHEMBL4159562 Ki = 7.4 nM 8.13
CHEMBL4167473 Ki = 22.1 nM 7.66
CHEMBL4160295 Ki = 23.4 nM 7.63
CHEMBL20 ACETAZOLAMIDE Ki = 25.0 nM 7.60
CHEMBL4174345 Ki = 47.6 nM 7.32
CHEMBL218490 DORZOLAMIDE Ki = 52.0 nM 7.28
CHEMBL4162920 Ki = 53.6 nM 7.27
CHEMBL4162590 Ki = 59.2 nM 7.23
CHEMBL4170860 Ki = 61.8 nM 7.21
CHEMBL4166379 Ki = 74.7 nM 7.13
CHEMBL4174295 Ki = 83.1 nM 7.08
CHEMBL4170519 Ki = 84.6 nM 7.07
CHEMBL4170536 Ki = 93.1 nM 7.03
CHEMBL4161638 Ki = 95.4 nM 7.02
CHEMBL4163665 Ki = 107.7 nM 6.97
CHEMBL4173735 Ki = 126.5 nM 6.90