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Assay Detail

CHEMBL1826563

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

Binding
Competitive inhibition of Mycobacterium tuberculosis DHQ2
20
Total Activities
20
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

3-dehydroquinate dehydratase (CHEMBL3345)
Type SINGLE PROTEIN
Organism Mycobacterium tuberculosis

Publication

A prodrug approach for improving antituberculosis activity of potent Mycobacterium tuberculosis type II dehydroquinase inhibitors.
Tizón L, Otero JM, Prazeres VF, Llamas-Saiz AL, Fox GC, van Raaij MJ, Lamb H, Hawkins AR, Ainsa JA, Castedo L, González-Bello C.
J Med Chem (2011) 54 : 6063 -6084
PubMed 21780742 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 20 6.75 7.55

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL567563 1 7.55
CHEMBL576247 1 7.51
CHEMBL1823560 1 7.46
CHEMBL1823561 1 7.46
CHEMBL1823559 1 7.41
CHEMBL1823562 1 7.40
CHEMBL567564 1 7.37
CHEMBL188524 1 7.27
CHEMBL1823571 1 7.23
CHEMBL1823558 1 6.92
CHEMBL1823563 1 6.73
CHEMBL567136 1 6.63
CHEMBL1823569 1 6.60
CHEMBL1823557 1 6.60
CHEMBL1823565 1 6.36
CHEMBL1823570 1 6.06
CHEMBL1823564 1 5.96
CHEMBL1823568 1 5.91
CHEMBL1823567 1 5.29
CHEMBL1823566 1 5.22

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL567563 Ki = 28.0 nM 7.55
CHEMBL576247 Ki = 31.0 nM 7.51
CHEMBL1823560 Ki = 35.0 nM 7.46
CHEMBL1823561 Ki = 35.0 nM 7.46
CHEMBL1823559 Ki = 39.0 nM 7.41
CHEMBL1823562 Ki = 40.0 nM 7.40
CHEMBL567564 Ki = 42.5 nM 7.37
CHEMBL188524 Ki = 54.0 nM 7.27
CHEMBL1823571 Ki = 59.0 nM 7.23
CHEMBL1823558 Ki = 120.0 nM 6.92
CHEMBL1823563 Ki = 188.0 nM 6.73
CHEMBL567136 Ki = 235.0 nM 6.63
CHEMBL1823569 Ki = 250.0 nM 6.60
CHEMBL1823557 Ki = 250.0 nM 6.60
CHEMBL1823565 Ki = 440.0 nM 6.36
CHEMBL1823570 Ki = 870.0 nM 6.06
CHEMBL1823564 Ki = 1100.0 nM 5.96
CHEMBL1823568 Ki = 1240.0 nM 5.91
CHEMBL1823567 Ki = 5100.0 nM 5.29
CHEMBL1823566 Ki = 6000.0 nM 5.22