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Assay Detail

CHEMBL4432501

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

Binding
Steady state inhibition of Sporosarcina pasteurii CCM 2056 urease using urea as substrate assessed as inhibition constant for final enzyme conformation-inhibitor complex by measuring ammonia levels after 120 mins by phenol-hypochlorite method
25
Total Activities
25
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Sporosarcina pasteurii
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

1,2-Benzisoselenazol-3(2H)-one Derivatives As a New Class of Bacterial Urease Inhibitors.
Macegoniuk K, Grela E, Palus J, Rudzińska-Szostak E, Grabowiecka A, Biernat M, Berlicki Ł.
J Med Chem (2016) 59 : 8125 -8133
PubMed 27524377 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 25 6.76 8.68

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL51085 EBSELEN 3.0 1 8.68
CHEMBL4575318 1 8.46
CHEMBL4539240 1 8.34
CHEMBL4471428 1 8.18
CHEMBL385817 EBSELEN DISELENIDE 1 8.03
CHEMBL4469439 1 7.92
CHEMBL3655716 1 7.61
CHEMBL4469463 1 7.58
CHEMBL4563587 1 7.49
CHEMBL4444060 1 7.12
CHEMBL4089739 1 7.08
CHEMBL4524305 1 6.86
CHEMBL4563580 1 6.79
CHEMBL4555455 1 6.28
CHEMBL4444989 1 6.09
CHEMBL4534596 1 6.05
CHEMBL4463967 1 6.03
CHEMBL4592440 1 6.00
CHEMBL4552531 1 5.92
CHEMBL4520558 1 5.62
CHEMBL734 ACETOHYDROXAMIC ACID 4.0 1 5.48
CHEMBL3747547 1 4.99
CHEMBL3747132 1 4.83
CHEMBL4461450 1 4.82
CHEMBL1976884 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL51085 EBSELEN Ki = 2.11 nM 8.68
CHEMBL4575318 Ki = 3.48 nM 8.46
CHEMBL4539240 Ki = 4.62 nM 8.34
CHEMBL4471428 Ki = 6.67 nM 8.18
CHEMBL385817 EBSELEN DISELENIDE Ki = 9.44 nM 8.03
CHEMBL4469439 Ki = 12.1 nM 7.92
CHEMBL3655716 Ki = 24.7 nM 7.61
CHEMBL4469463 Ki = 26.1 nM 7.58
CHEMBL4563587 Ki = 32.6 nM 7.49
CHEMBL4444060 Ki = 76.3 nM 7.12
CHEMBL4089739 Ki = 84.0 nM 7.08
CHEMBL4524305 Ki = 139.2 nM 6.86
CHEMBL4563580 Ki = 164.2 nM 6.79
CHEMBL4555455 Ki = 528.0 nM 6.28
CHEMBL4444989 Ki = 806.0 nM 6.09
CHEMBL4534596 Ki = 883.2 nM 6.05
CHEMBL4463967 Ki = 936.0 nM 6.03
CHEMBL4592440 Ki = 1007.0 nM 6.00
CHEMBL4552531 Ki = 1210.0 nM 5.92
CHEMBL4520558 Ki = 2410.0 nM 5.62
CHEMBL734 ACETOHYDROXAMIC ACID Ki = 3300.0 nM 5.48
CHEMBL3747547 Ki = 10300.0 nM 4.99
CHEMBL3747132 Ki = 14900.0 nM 4.83
CHEMBL4461450 Ki = 15100.0 nM 4.82
CHEMBL1976884 Ki = 319000.0 nM -