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Assay Detail

CHEMBL880254

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

Binding
Inhibition of recombinant Trypanosoma brucei soluble vacuolar pyrophosphatase expressed in Escherichia coli
81
Total Activities
81
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Trypanosoma brucei
Confidence 9 — Direct single protein target
Curated By Expert

Target

Vacuolar-type proton translocating pyrophosphatase 1 (CHEMBL4386)
Type SINGLE PROTEIN
Organism Trypanosoma brucei

Publication

Bisphosphonate inhibition of the exopolyphosphatase activity of the Trypanosoma brucei soluble vacuolar pyrophosphatase.
Kotsikorou E, Song Y, Chan JM, Faelens S, Tovian Z, Broderick E, Bakalara N, Docampo R, Oldfield E.
J Med Chem (2005) 48 : 6128 -6139
PubMed 16162013 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 81 4.69 5.68

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL414849 1 5.68
CHEMBL54925 1 5.62
CHEMBL370662 1 5.42
CHEMBL191613 2,4-DICHLOROPHENYLAMINOMETHYLENEBISPHOSPHONIC ACID 1 5.37
CHEMBL55371 1 5.37
CHEMBL102478 1 5.26
CHEMBL196254 1 5.21
CHEMBL450938 (3-NITROPHENYLAMINO)METHYLENEDIPHOSPHONIC ACID 1 5.19
CHEMBL195034 1 5.12
CHEMBL199206 1 5.10
CHEMBL371456 1 5.05
CHEMBL55889 1 5.01
CHEMBL364728 1 5.01
CHEMBL198409 1 5.01
CHEMBL198826 1 5.00
CHEMBL443750 1 4.99
CHEMBL299988 1 4.99
CHEMBL192881 1 4.95
CHEMBL198126 1 4.95
CHEMBL197836 1 4.91
CHEMBL299491 1 4.90
CHEMBL333503 1 4.88
CHEMBL198380 1 4.83
CHEMBL300755 1 4.79
CHEMBL125188 1 4.78
CHEMBL196631 1 4.76
CHEMBL196554 1 4.73
CHEMBL370330 1 4.72
CHEMBL52761 1 4.67
CHEMBL194800 1 4.61

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL414849 IC50 = 2100.0 nM 5.68
CHEMBL54925 IC50 = 2400.0 nM 5.62
CHEMBL370662 IC50 = 3800.0 nM 5.42
CHEMBL191613 2,4-DICHLOROPHENYLAMINOMETHYLENEBISPHOSPHONIC ACID IC50 = 4300.0 nM 5.37
CHEMBL55371 IC50 = 4300.0 nM 5.37
CHEMBL102478 IC50 = 5500.0 nM 5.26
CHEMBL196254 IC50 = 6200.0 nM 5.21
CHEMBL450938 (3-NITROPHENYLAMINO)METHYLENEDIPHOSPHONIC ACID IC50 = 6500.0 nM 5.19
CHEMBL195034 IC50 = 7500.0 nM 5.12
CHEMBL199206 IC50 = 8000.0 nM 5.10
CHEMBL371456 IC50 = 9000.0 nM 5.05
CHEMBL55889 IC50 = 9700.0 nM 5.01
CHEMBL364728 IC50 = 9700.0 nM 5.01
CHEMBL198409 IC50 = 9700.0 nM 5.01
CHEMBL198826 IC50 = 10000.0 nM 5.00
CHEMBL443750 IC50 = 10200.0 nM 4.99
CHEMBL299988 IC50 = 10300.0 nM 4.99
CHEMBL192881 IC50 = 11300.0 nM 4.95
CHEMBL198126 IC50 = 11300.0 nM 4.95
CHEMBL197836 IC50 = 12300.0 nM 4.91
CHEMBL299491 IC50 = 12700.0 nM 4.90
CHEMBL333503 IC50 = 13300.0 nM 4.88
CHEMBL198380 IC50 = 14700.0 nM 4.83
CHEMBL300755 IC50 = 16300.0 nM 4.79
CHEMBL125188 IC50 = 16700.0 nM 4.78
CHEMBL196631 IC50 = 17300.0 nM 4.76
CHEMBL196554 IC50 = 18700.0 nM 4.73
CHEMBL370330 IC50 = 19000.0 nM 4.72
CHEMBL52761 IC50 = 21500.0 nM 4.67
CHEMBL194800 IC50 = 24300.0 nM 4.61
CHEMBL127588 IC50 = 25300.0 nM 4.60
CHEMBL199012 IC50 = 25300.0 nM 4.60
CHEMBL194801 IC50 = 25000.0 nM 4.60
CHEMBL198013 IC50 = 28300.0 nM 4.55
CHEMBL198439 IC50 = 28700.0 nM 4.54
CHEMBL381465 IC50 = 29700.0 nM 4.53
CHEMBL196676 IC50 = 31000.0 nM 4.51
CHEMBL196726 IC50 = 35300.0 nM 4.45
CHEMBL431139 IC50 = 38000.0 nM 4.42
CHEMBL434978 IC50 = 39700.0 nM 4.40
CHEMBL382754 IC50 = 42700.0 nM 4.37
CHEMBL55608 (BUTYLAMINO)METHYLENEDIPHOSPHONIC ACID IC50 = 43300.0 nM 4.36
CHEMBL53950 INCADRONIC ACID IC50 = 44300.0 nM 4.35
CHEMBL199254 IC50 = 44700.0 nM 4.35
CHEMBL192793 IC50 = 46700.0 nM 4.33
CHEMBL299717 (PROPYLAMINO)METHYLENEDIPHOSPHONIC ACID IC50 = 47700.0 nM 4.32
CHEMBL110971 IC50 = 47700.0 nM 4.32
CHEMBL371673 IC50 = 48000.0 nM 4.32
CHEMBL197935 IC50 = 49700.0 nM 4.30
CHEMBL371264 IC50 = 52300.0 nM 4.28