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Assay Detail

CHEMBL1695104

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

Binding
Inhibition of Mycobacterium tuberculosis recombinant Rv1284 beta-carbonic anhydrase after 15 mins by stopped flow CO2 hydration assay
27
Total Activities
27
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Mycobacterium tuberculosis
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Beta-carbonic anhydrase 1 (CHEMBL5631)
Type SINGLE PROTEIN
Organism Mycobacterium tuberculosis

Publication

Natural product-based phenols as novel probes for mycobacterial and fungal carbonic anhydrases.
Davis RA, Hofmann A, Osman A, Hall RA, Mühlschlegel FA, Vullo D, Innocenti A, Supuran CT, Poulsen SA.
J Med Chem (2011) 54 : 1682 -1692
PubMed 21332115 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 27 5.56 6.32

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL20 ACETAZOLAMIDE 4.0 1 6.32
CHEMBL220492 TOPIRAMATE 4.0 1 6.21
CHEMBL463134 (+)-XYLARIAMIDE A 1 6.15
CHEMBL601464 1 6.10
CHEMBL517222 ENDIANDRIN B 1 6.10
CHEMBL228274 ENDIANDRIN A 1 6.09
CHEMBL463133 (-)-XYLARIAMIDE A 1 6.08
CHEMBL53566 TYROSOL 1 6.07
CHEMBL447310 1 6.07
CHEMBL375927 (-)-DIHYDROGUAIARETICACID 1 6.07
CHEMBL591736 POLYANDROCARPAMINE B 1 6.04
CHEMBL590883 1 6.00
CHEMBL606453 1 5.94
CHEMBL589606 1 5.90
CHEMBL589604 1 5.75
CHEMBL21 SULFANILAMIDE 4.0 1 5.01
CHEMBL592010 1 4.99
CHEMBL592384 1 4.98
CHEMBL592140 1 4.98
CHEMBL1772 1 4.97
CHEMBL588491 1 4.96
CHEMBL605189 1 4.94
CHEMBL603189 POLYANDROCARPAMINE A 1 4.93
CHEMBL578932 1 4.91
CHEMBL589354 1 4.91
CHEMBL14060 PHENOL 4.0 1 4.19
CHEMBL750 ZONISAMIDE 4.0 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL20 ACETAZOLAMIDE Ki = 480.0 nM 6.32
CHEMBL220492 TOPIRAMATE Ki = 610.0 nM 6.21
CHEMBL463134 (+)-XYLARIAMIDE A Ki = 710.0 nM 6.15
CHEMBL601464 Ki = 800.0 nM 6.10
CHEMBL517222 ENDIANDRIN B Ki = 800.0 nM 6.10
CHEMBL228274 ENDIANDRIN A Ki = 820.0 nM 6.09
CHEMBL463133 (-)-XYLARIAMIDE A Ki = 840.0 nM 6.08
CHEMBL53566 TYROSOL Ki = 850.0 nM 6.07
CHEMBL447310 Ki = 850.0 nM 6.07
CHEMBL375927 (-)-DIHYDROGUAIARETICACID Ki = 850.0 nM 6.07
CHEMBL591736 POLYANDROCARPAMINE B Ki = 910.0 nM 6.04
CHEMBL590883 Ki = 990.0 nM 6.00
CHEMBL606453 Ki = 1160.0 nM 5.94
CHEMBL589606 Ki = 1270.0 nM 5.90
CHEMBL589604 Ki = 1780.0 nM 5.75
CHEMBL21 SULFANILAMIDE Ki = 9840.0 nM 5.01
CHEMBL592010 Ki = 10300.0 nM 4.99
CHEMBL592384 Ki = 10500.0 nM 4.98
CHEMBL592140 Ki = 10500.0 nM 4.98
CHEMBL1772 Ki = 10800.0 nM 4.97
CHEMBL588491 Ki = 11000.0 nM 4.96
CHEMBL605189 Ki = 11600.0 nM 4.94
CHEMBL603189 POLYANDROCARPAMINE A Ki = 11800.0 nM 4.93
CHEMBL578932 Ki = 12300.0 nM 4.91
CHEMBL589354 Ki = 12200.0 nM 4.91
CHEMBL14060 PHENOL Ki = 64000.0 nM 4.19
CHEMBL750 ZONISAMIDE Ki = 286800.0 nM -