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Assay Detail

CHEMBL1044458

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Binding
Inhibition of human carbonic anhydrase 7 by stopped flow CO2 hydration assay
21
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Carbonic anhydrase 7 (CHEMBL2326)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Deciphering the mechanism of carbonic anhydrase inhibition with coumarins and thiocoumarins.
Maresca A, Temperini C, Pochet L, Masereel B, Scozzafava A, Supuran CT.
J Med Chem (2010) 53 : 335 -344
PubMed 19911821 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 21 5.20 7.50

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL577123 1 7.50
CHEMBL572366 1 7.01
CHEMBL49732 HERNIARIN 1 5.62
CHEMBL567896 1 5.50
CHEMBL6466 COUMARIN 4.0 1 5.48
CHEMBL571519 1 5.43
CHEMBL571514 7-BUTOXYCOUMARIN 1 5.39
CHEMBL83294 COUMARIN-3-CARBOXYLIC ACID 1 5.21
CHEMBL568516 7-PROPOXYCOUMARIN 1 5.15
CHEMBL191528 ETHOXYCOUMARIN 1 5.11
CHEMBL578167 1 5.05
CHEMBL567139 1 5.05
CHEMBL568385 1 5.01
CHEMBL568173 1 4.84
CHEMBL145781 7-BENZYLOXYCOUMARIN 1 4.82
CHEMBL571738 1 4.77
CHEMBL12567 1 4.52
CHEMBL568417 1 4.50
CHEMBL568348 1 4.49
CHEMBL567544 1 4.35
CHEMBL568416 1 4.30

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL577123 Ki = 32.0 nM 7.50
CHEMBL572366 Ki = 98.0 nM 7.01
CHEMBL49732 HERNIARIN Ki = 2400.0 nM 5.62
CHEMBL567896 Ki = 3200.0 nM 5.50
CHEMBL6466 COUMARIN Ki = 3300.0 nM 5.48
CHEMBL571519 Ki = 3700.0 nM 5.43
CHEMBL571514 7-BUTOXYCOUMARIN Ki = 4100.0 nM 5.39
CHEMBL83294 COUMARIN-3-CARBOXYLIC ACID Ki = 6200.0 nM 5.21
CHEMBL568516 7-PROPOXYCOUMARIN Ki = 7100.0 nM 5.15
CHEMBL191528 ETHOXYCOUMARIN Ki = 7800.0 nM 5.11
CHEMBL578167 Ki = 8900.0 nM 5.05
CHEMBL567139 Ki = 9000.0 nM 5.05
CHEMBL568385 Ki = 9700.0 nM 5.01
CHEMBL568173 Ki = 14500.0 nM 4.84
CHEMBL145781 7-BENZYLOXYCOUMARIN Ki = 15300.0 nM 4.82
CHEMBL571738 Ki = 17100.0 nM 4.77
CHEMBL12567 Ki = 30100.0 nM 4.52
CHEMBL568417 Ki = 31400.0 nM 4.50
CHEMBL568348 Ki = 32400.0 nM 4.49
CHEMBL567544 Ki = 44500.0 nM 4.35
CHEMBL568416 Ki = 50500.0 nM 4.30