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Assay Detail

CHEMBL4737829

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

Functional
Antiplasmodial activity against multidrug-sensitive Plasmodium falciparum NF54 transfected with GFP-Luc infected in human erythrocytes assessed as reduction in [3H]-hypoxanthine incorporation pretreated for 48 hrs followed by [3H]-hypoxanthine addition measured after 24 hrs by liquid scintillation counting method
32
Total Activities
29
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Plasmodium falciparum
Cell Type Erythrocyte
Confidence 1 — Organism
Curated By Autocuration

Target

Plasmodium falciparum (CHEMBL364)
Type ORGANISM
Organism Plasmodium falciparum

Publication

Identification and Profiling of a Novel Diazaspiro[3.4]octane Chemical Series Active against Multiple Stages of the Human Malaria Parasite Plasmodium falciparum and Optimization Efforts.
Le Manach C,Dam J,Woodland JG,Kaur G,Khonde LP,Brunschwig C,Njoroge M,Wicht KJ,Horatscheck A,Paquet T,Boyle GA,Gibhard L,Taylor D,Lawrence N,Yeo T,Mok S,Eastman RT,Dorjsuren D,Talley DC,Guo H,Simeonov A,Reader J,van der Watt M,Erlank E,Venter N,Zawada JW,Aswat A,Nardini L,Coetzer TL,Lauterbach SB,Bezuidenhout BC,Theron A,Mancama D,Koekemoer LL,Birkholtz LM,Wittlin S,Delves M,Ottilie S,Winzeler EA,von Geldern TW,Smith D,Fidock DA,Street LJ,Basarab GS,Duffy J,Chibale K
J Med Chem (2021) 64 : 2291 -2309
PubMed 33573376 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 32 6.81 7.85

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4756352 1 7.85
CHEMBL4755397 1 7.85
CHEMBL4797995 1 7.82
CHEMBL2058833 GANAPLACIDE 2.0 1 7.80
CHEMBL4763437 1 7.77
CHEMBL2041980 MMV-048 2.0 1 7.55
CHEMBL4750683 1 7.52
CHEMBL4759714 1 7.48
CHEMBL4799348 1 7.44
CHEMBL4764956 3 7.36
CHEMBL4791555 1 7.36
CHEMBL4780165 1 7.35
CHEMBL4743418 2 7.24
CHEMBL4745404 1 7.12
CHEMBL4741532 1 6.99
CHEMBL4795434 1 6.96
CHEMBL4754515 1 6.89
CHEMBL4753689 1 6.44
CHEMBL4756151 1 6.07
CHEMBL4760020 1 5.60
CHEMBL4744339 1 5.57
CHEMBL4756502 1 5.51
CHEMBL4755921 1 5.38
CHEMBL4761821 1 5.34
CHEMBL4777583 1 5.29
CHEMBL4794192 1 -
CHEMBL4790005 1 -
CHEMBL4779239 1 -
CHEMBL4748764 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4756352 IC50 = 14.0 nM 7.85
CHEMBL4755397 IC50 = 14.0 nM 7.85
CHEMBL4797995 IC50 = 15.0 nM 7.82
CHEMBL2058833 GANAPLACIDE IC50 = 16.0 nM 7.80
CHEMBL4763437 IC50 = 17.0 nM 7.77
CHEMBL2041980 MMV-048 IC50 = 28.0 nM 7.55
CHEMBL4750683 IC50 = 30.0 nM 7.52
CHEMBL4759714 IC50 = 33.0 nM 7.48
CHEMBL4799348 IC50 = 36.0 nM 7.44
CHEMBL4764956 IC50 = 44.0 nM 7.36
CHEMBL4791555 IC50 = 44.0 nM 7.36
CHEMBL4780165 IC50 = 45.0 nM 7.35
CHEMBL4743418 IC50 = 57.0 nM 7.24
CHEMBL4745404 IC50 = 75.0 nM 7.12
CHEMBL4741532 IC50 = 103.0 nM 6.99
CHEMBL4795434 IC50 = 110.0 nM 6.96
CHEMBL4754515 IC50 = 130.0 nM 6.89
CHEMBL4764956 IC50 = 140.0 nM 6.85
CHEMBL4753689 IC50 = 360.0 nM 6.44
CHEMBL4756151 IC50 = 860.0 nM 6.07
CHEMBL4760020 IC50 = 2500.0 nM 5.60
CHEMBL4744339 IC50 = 2700.0 nM 5.57
CHEMBL4756502 IC50 = 3100.0 nM 5.51
CHEMBL4755921 IC50 = 4200.0 nM 5.38
CHEMBL4764956 IC50 = 4400.0 nM 5.36
CHEMBL4761821 IC50 = 4600.0 nM 5.34
CHEMBL4777583 IC50 = 5100.0 nM 5.29
CHEMBL4794192 IC50 > 6000.0 nM -
CHEMBL4790005 IC50 > 6000.0 nM -
CHEMBL4779239 IC50 > 6000.0 nM -
CHEMBL4748764 IC50 > 6000.0 nM -
CHEMBL4743418 IC50 = 230000.0 nM -