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Assay Detail

CHEMBL4036365

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ADMET
Inhibition of recombinant human cytosolic carbonic anhydrase 2 expressed in Escherichia coli pretreated for 15 mins prior to testing by stopped-flow assay
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Carbonic anhydrase 2 (CHEMBL205)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Novel sulfonamide-containing 2-indolinones that selectively inhibit tumor-associated alpha carbonic anhydrases.
Karalı N, Akdemir A, Göktaş F, Eraslan Elma P, Angeli A, Kızılırmak M, Supuran CT.
Bioorg Med Chem (2017) 25 : 3714 -3718
PubMed 28545816 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 14 6.51 7.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL20 ACETAZOLAMIDE 4.0 1 7.92
CHEMBL4104834 1 7.57
CHEMBL4097126 1 7.50
CHEMBL4069928 1 6.40
CHEMBL4099555 1 6.38
CHEMBL4072614 1 6.37
CHEMBL4081547 1 6.26
CHEMBL4061260 1 6.21
CHEMBL4064015 1 6.16
CHEMBL4070963 1 6.13
CHEMBL4093328 1 6.11
CHEMBL4089415 1 6.07
CHEMBL4080604 1 6.05
CHEMBL4091812 1 6.03

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL20 ACETAZOLAMIDE Ki = 12.1 nM 7.92
CHEMBL4104834 Ki = 26.9 nM 7.57
CHEMBL4097126 Ki = 32.0 nM 7.50
CHEMBL4069928 Ki = 399.4 nM 6.40
CHEMBL4099555 Ki = 420.0 nM 6.38
CHEMBL4072614 Ki = 425.6 nM 6.37
CHEMBL4081547 Ki = 551.0 nM 6.26
CHEMBL4061260 Ki = 616.0 nM 6.21
CHEMBL4064015 Ki = 687.0 nM 6.16
CHEMBL4070963 Ki = 735.0 nM 6.13
CHEMBL4093328 Ki = 782.1 nM 6.11
CHEMBL4089415 Ki = 851.0 nM 6.07
CHEMBL4080604 Ki = 897.0 nM 6.05
CHEMBL4091812 Ki = 936.0 nM 6.03