Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | IRAK4 | Q9NWZ3 | 14/20 | 0.49 |
| ▸ | PIM1 | P11309 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.43 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.42 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2732168 | 0.86 | CHEK1 (0.49) | CHEK1IRAK4PIM1PIM3PIM2 | |
| SCHEMBL14328713 | 0.85 | CHEK1 (0.70) | CHEK1NPC1RAB9AIRAK4PIM1 | |
| SCHEMBL2732421 | 0.80 | CHEK1 (0.49) | CHEK1IRAK4PIM1PIM3PIM2 | |
| SCHEMBL2727745 | 0.79 | CHEK1 (0.35) | CHEK1IRAK4PIM1PIM3PIM2 | |
| SCHEMBL2728269 | 0.79 | IRAK4 (0.47) | IRAK4 | |
| SCHEMBL2729048 | 0.79 | CHEK1 (0.53) | CHEK1NPC1RAB9AMAPK1ATM | |
| SCHEMBL14206614 | 0.79 | CHEK1 (0.55) | CHEK1 | |
| SCHEMBL2728078 | 0.78 | CHEK1 (0.56) | CHEK1PIM1PIM3PIM2 | |
| SCHEMBL2730086 | 0.78 | CHEK1 (0.41) | CHEK1MAPK1IRAK4 | |
| SCHEMBL14206459 | 0.77 | CHEK1 (0.54) | CHEK1IRAK4PIM1PIM3PIM2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2632263-A1 | NOVEL THIAZOLE-CARBOXAMIDE DERIVATIVES AS PDK1 INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2013-09-04 | — | — | EP | claimed |
| WO-2012058174-A1 | NOVEL THIAZOLE-CARBOXAMIDE DERIVATIVES AS PDK1 INHIBITORS | SCHERING CORPORATION (US) | 2012-05-03 | — | — | WO | claimed |