Cluster | Sample ID | Structure | Gametocyte, IC50 (µM) | Asexual, IC50 (µM) | HepG2, IC50 (µM) | Asexual/Gametocyte |
---|---|---|---|---|---|---|
Cluster 1 2,4-diaminopyrimidines | NCGC00134128 |
| 1.18 ± 0.17 | 1.93 ± 0.13 | – | 1.64 |
 | NCGC00134154 |
| 1.19 ± 0.34 | 2.83 ± 0.31 | – | 2.38 |
 | NCGC00134126 |
| 1.19 ± 0.05 | 4.78 ± 0.43 | – | 4.02 |
 | NCGC00134130 |
| 1.42 ± 0.24 | 3.26 ± 0.50 | – | 2.30 |
 | NCGC00134124 |
| 1.55 ± 0.11 | 5.96 ± 0.70 | – | 3.85 |
 | NCGC00134158 |
| 2.08 ± 0.18 | 4.70 ± 0.52 | – | 2.26 |
 | NCGC00134156 |
| 2.10 ± 0.73 | 3.53 ± 0.27 | – | 1.68 |
 | NCGC00134132 |
| 1.29 ± 0.32 | 2.41 ± 0.32 | – | 1.87 |
 | NCGC00134136 |
| 2.57 ± 0.48 | 4.12 ± 0.10 | – | 1.60 |
 | NCGC00134134 |
| 1.10 ± 0.16 | 3.12 ± 0.87 | – | 2.84 |
Cluster 2 3-amino-imidazo[1,2-a]pyridines | NCGC00104490 |
| 1.29 ± 0.29 | 2.22 ± 0.35 | – | 1.72 |
 | NCGC00106055 |
| 3.98 ± 1.12 | 4.18 ± 0.68 | – | 1.05 |
 | NCGC00106087 |
| 3.34 ± 0.51 | 7.49 ± 4.11 | – | 2.24 |
 | NCGC00106780 |
| 1.82 ± 0.11 | 3.53 ± 1.21 | – | 1.94 |
 | NCGC00106091 |
| 2.45 ± 0.42 | 4.51 ± 1.29 | – | 1.84 |
 | NCGC00106119 |
| 2.82 ± 0.30 | 4.22 ± 0.29 | – | 1.50 |
 | NCGC00104528 |
| 8.91 ± 0.20 | 13.9 ± 0.93 | – | 1.56 |
Cluster 3 4H-chromen-4-ones | NCGC00100599 |
| 4.34 ± 0.60 | 0.34 ± 0.03 | – | 0.08 |
 | NCGC00101506 |
| 4.82 ± 0.21 | 0.54 ± 0.05 | – | 0.11 |
 | NCGC00141020 |
| 4.86 ± 0.03 | 1.07 ± 0.37 | – | 0.22 |
 | NCGC00100597 |
| 6.04 ± 1.90 | 0.63 ± 0.05 | – | 0.10 |
Cluster 4 4-1H-pyrazol-5-yl piperidines | NCGC00127017 |
| 11.9 ± 2.05 | 3.44 ± 0.24 | 25.3 ± 5.41 | 0.29 |
 | NCGC00126892 |
| 31.3 ± 12.8 | 7.49 ± 0.86 | 34.4 ± 5.36 | 0.24 |
 | NCGC00127015 |
| 20.3 ± 0.31 | 3.05 ± 0.27 | 38.4 ± 0.48 | 0.15 |
 | NCGC00126987 |
| 30.6 ± 1.95 | 1.47 ± 0.04 | 38.6 ± 0.42 | 0.05 |
 | NCGC00124960 |
| ~60 | 35.6 ± 1.77 | – | 0.59 |
Cluster 5 8-quinolinol | NCGC00114940a |
| 0.62 ± 0.04 | 1.16 ± 0.57 | – | 1.87 |
Cluster 6 3H-imidazo[4,5-b]pyridine | NCGC00134795 |
| 4.25 ± 0.64 | 0.96 ± 0.30 | – | 0.23 |
Cluster 7 thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine | NCGC00123034 |
| 35.2 ± 4.52 | 32.1 ± 12.6 | – | 0.92 |
Cluster 8 1 2 3 4-tetrahydroacridine | NCGC00110901 |
| 10.6 ± 1.32 | 36.1 ± 15.2 | – | 3.41 |
Cluster 9 thieno[2,3-d]pyrimidine | NCGC00104044 |
| 38.7 ± 57.9 | 9.94 ± 0.93 | – | 0.26 |
Cluster 10 10,11-dihydrodibenzo[b,f][1,4]thiazepine | NCGC00140326 |
| ~60 | 13.8 ± 0.82 | – | 0.23 |