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Assay Detail

CHEMBL816154

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Binding
Inhibitory activity against thymidine monophosphate kinase (TMPK) in Mycobacterium tuberculosis
29
Total Activities
28
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Thymidylate kinase (CHEMBL2361)
Type SINGLE PROTEIN
Organism Mycobacterium tuberculosis

Publication

Thymidine and thymidine-5'-O-monophosphate analogues as inhibitors of Mycobacterium tuberculosis thymidylate kinase.
Vanheusden V, Van Rompaey P, Munier-Lehmann H, Pochet S, Herdewijn P, Van Calenbergh S.
Bioorg Med Chem Lett (2003) 13 : 3045 -3048
PubMed 12941330 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 29 4.62 5.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL102454 1 5.30
CHEMBL102425 1 5.16
CHEMBL257695 AZIDOTHYMIDINE MONOPHOSPHATE 1 5.00
CHEMBL319447 1 4.92
CHEMBL1160604 1 4.72
CHEMBL52609 DOXRIBTIMINE 2.0 2 4.57
CHEMBL129 ZIDOVUDINE 4.0 1 4.55
CHEMBL105318 ALOVUDINE 2.0 1 4.55
CHEMBL1160814 1 4.55
CHEMBL1160603 1 4.37
CHEMBL1160596 1 4.35
CHEMBL322925 1 4.05
CHEMBL1129 TRIFLURIDINE 4.0 1 4.01
CHEMBL103283 1 -
CHEMBL105524 1 -
CHEMBL318153 EDOXUDINE 2.0 1 -
CHEMBL1130 DOXIFLURIDINE 3.0 1 -
CHEMBL103356 3-AMINO- 3-DEOXYTHYMIDINE 1 -
CHEMBL1160818 1 -
CHEMBL54918 5-FLUOROURIDINE 2.0 1 -
CHEMBL1160817 1 -
CHEMBL102479 1 -
CHEMBL1160806 1 -
CHEMBL1160597 1 -
CHEMBL1160592 1 -
CHEMBL1160816 1 -
CHEMBL320200 1 -
CHEMBL102768 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL102454 Ki = 5000.0 nM 5.30
CHEMBL102425 Ki = 7000.0 nM 5.16
CHEMBL257695 AZIDOTHYMIDINE MONOPHOSPHATE Ki = 10000.0 nM 5.00
CHEMBL319447 Ki = 12000.0 nM 4.92
CHEMBL1160604 Ki = 19000.0 nM 4.72
CHEMBL52609 DOXRIBTIMINE Ki = 27000.0 nM 4.57
CHEMBL129 ZIDOVUDINE Ki = 28000.0 nM 4.55
CHEMBL105318 ALOVUDINE Ki = 28000.0 nM 4.55
CHEMBL1160814 Ki = 28000.0 nM 4.55
CHEMBL1160603 Ki = 43000.0 nM 4.37
CHEMBL1160596 Ki = 45000.0 nM 4.35
CHEMBL322925 Ki = 90000.0 nM 4.05
CHEMBL1129 TRIFLURIDINE Ki = 97000.0 nM 4.01
CHEMBL103283 Ki = 238000.0 nM -
CHEMBL105524 Ki = 122000.0 nM -
CHEMBL318153 EDOXUDINE Ki = 1140000.0 nM -
CHEMBL1130 DOXIFLURIDINE Ki = 560000.0 nM -
CHEMBL103356 3-AMINO- 3-DEOXYTHYMIDINE Ki = 230000.0 nM -
CHEMBL52609 DOXRIBTIMINE Ki = 715000.0 nM -
CHEMBL1160818 Ki = 110000.0 nM -
CHEMBL54918 5-FLUOROURIDINE Ki = 521000.0 nM -
CHEMBL1160817 Ki = 150000.0 nM -
CHEMBL102479 Ki = 490000.0 nM -
CHEMBL1160806 Ki = 270000.0 nM -
CHEMBL1160597 Ki = 235000.0 nM -
CHEMBL1160592 Ki = 120000.0 nM -
CHEMBL1160816 Ki = 140000.0 nM -
CHEMBL320200 Ki = 140000.0 nM -
CHEMBL102768 Ki = 1900000.0 nM -