Assay Detail
Binding
CHEMBL832347
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Inhibition of Plasmodium falciparum cyclin-dependent kinase
46
Total Activities
45
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Plasmodium falciparum |
| Confidence | 9 — Direct single protein target |
| Curated By | Expert |
Publication
A three-dimensional in silico pharmacophore model for inhibition of Plasmodium falciparum cyclin-dependent kinases and discovery of different classes of novel Pfmrk specific inhibitors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 46 | 4.86 | 6.89 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL365701 | — | — | 1 | 6.89 |
| CHEMBL127798 | — | — | 1 | 5.85 |
| CHEMBL363357 | — | — | 1 | 5.60 |
| CHEMBL365922 | — | — | 1 | 5.54 |
| CHEMBL363491 | — | — | 1 | 5.51 |
| CHEMBL360002 | — | — | 1 | 5.46 |
| CHEMBL187800 | — | — | 1 | 5.44 |
| CHEMBL190880 | — | — | 1 | 5.40 |
| CHEMBL388978 | STAUROSPORINE | — | 1 | 5.40 |
| CHEMBL187652 | — | — | 1 | 5.33 |
| CHEMBL118305 | 5-NITROISATIN | — | 1 | 5.23 |
| CHEMBL28 | APIGENIN | — | 1 | 5.16 |
| CHEMBL424995 | — | — | 1 | 5.00 |
| CHEMBL187682 | — | — | 1 | 5.00 |
| CHEMBL363296 | — | — | 1 | 4.96 |
| CHEMBL416956 | MEFLOQUINE | 4.0 | 1 | 4.92 |
| CHEMBL363514 | — | — | 1 | 4.85 |
| CHEMBL296586 | KENPAULLONE | — | 1 | 4.82 |
| CHEMBL187926 | — | — | 1 | 4.77 |
| CHEMBL424203 | — | — | 1 | 4.77 |
| CHEMBL362785 | — | — | 1 | 4.77 |
| CHEMBL97218 | — | — | 1 | 4.75 |
| CHEMBL187434 | — | — | 1 | 4.75 |
| CHEMBL7463 | GF-109203 | — | 1 | 4.62 |
| CHEMBL188154 | — | — | 1 | 4.60 |
| CHEMBL188685 | — | — | 1 | 4.58 |
| CHEMBL188234 | — | — | 1 | 4.54 |
| CHEMBL188544 | — | — | 1 | 4.52 |
| CHEMBL126077 | INDIRUBIN-3-MONOXIME | — | 1 | 4.52 |
| CHEMBL187551 | — | — | 1 | 4.46 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL365701 | — | IC50 | = | 130.0 | nM | 6.89 |
| CHEMBL127798 | — | IC50 | = | 1400.0 | nM | 5.85 |
| CHEMBL363357 | — | IC50 | = | 2500.0 | nM | 5.60 |
| CHEMBL365922 | — | IC50 | = | 2900.0 | nM | 5.54 |
| CHEMBL363491 | — | IC50 | = | 3100.0 | nM | 5.51 |
| CHEMBL360002 | — | IC50 | = | 3500.0 | nM | 5.46 |
| CHEMBL187800 | — | IC50 | = | 3600.0 | nM | 5.44 |
| CHEMBL190880 | — | IC50 | = | 4000.0 | nM | 5.40 |
| CHEMBL388978 | STAUROSPORINE | IC50 | = | 4000.0 | nM | 5.40 |
| CHEMBL187652 | — | IC50 | = | 4700.0 | nM | 5.33 |
| CHEMBL118305 | 5-NITROISATIN | IC50 | = | 5900.0 | nM | 5.23 |
| CHEMBL28 | APIGENIN | IC50 | = | 7000.0 | nM | 5.16 |
| CHEMBL187682 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL424995 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL363296 | — | IC50 | = | 11000.0 | nM | 4.96 |
| CHEMBL416956 | MEFLOQUINE | IC50 | = | 12000.0 | nM | 4.92 |
| CHEMBL363514 | — | IC50 | = | 14000.0 | nM | 4.85 |
| CHEMBL296586 | KENPAULLONE | IC50 | = | 15000.0 | nM | 4.82 |
| CHEMBL187926 | — | IC50 | = | 17000.0 | nM | 4.77 |
| CHEMBL424203 | — | IC50 | = | 17000.0 | nM | 4.77 |
| CHEMBL362785 | — | IC50 | = | 17100.0 | nM | 4.77 |
| CHEMBL97218 | — | IC50 | = | 18000.0 | nM | 4.75 |
| CHEMBL187434 | — | IC50 | = | 18000.0 | nM | 4.75 |
| CHEMBL7463 | GF-109203 | IC50 | = | 24000.0 | nM | 4.62 |
| CHEMBL188154 | — | IC50 | = | 25000.0 | nM | 4.60 |
| CHEMBL188685 | — | IC50 | = | 26000.0 | nM | 4.58 |
| CHEMBL188234 | — | IC50 | = | 29000.0 | nM | 4.54 |
| CHEMBL126077 | INDIRUBIN-3-MONOXIME | IC50 | = | 30000.0 | nM | 4.52 |
| CHEMBL188544 | — | IC50 | = | 30000.0 | nM | 4.52 |
| CHEMBL187551 | — | IC50 | = | 35000.0 | nM | 4.46 |
| CHEMBL189045 | — | IC50 | = | 35800.0 | nM | 4.45 |
| CHEMBL363887 | — | IC50 | = | 38300.0 | nM | 4.42 |
| CHEMBL363887 | — | IC50 | = | 38000.0 | nM | 4.42 |
| CHEMBL556755 | — | IC50 | = | 46200.0 | nM | 4.33 |
| CHEMBL50894 | ALSTERPAULLONE | IC50 | = | 51000.0 | nM | 4.29 |
| CHEMBL189865 | — | IC50 | = | 61000.0 | nM | 4.21 |
| CHEMBL363972 | — | IC50 | = | 70000.0 | nM | 4.16 |
| CHEMBL187676 | — | IC50 | = | 69000.0 | nM | 4.16 |
| CHEMBL185627 | — | IC50 | = | 87000.0 | nM | 4.06 |
| CHEMBL44 | GENISTEIN | IC50 | = | 93000.0 | nM | 4.03 |
| CHEMBL164 | MYRICETIN | IC50 | = | 157000.0 | nM | - |
| CHEMBL185794 | — | IC50 | = | 182000.0 | nM | - |
| CHEMBL76 | CHLOROQUINE | IC50 | = | 150000.0 | nM | - |
| CHEMBL280074 | OLOMOUCINE | IC50 | = | 1100000.0 | nM | - |
| CHEMBL186130 | — | IC50 | = | 394000.0 | nM | - |
| CHEMBL337993 | — | IC50 | = | 138000.0 | nM | - |