Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 2/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 11/20 | 0.37 |
| ▸ | NTRK3 | Q16288 | 6/20 | 0.37 |
| ▸ | NTRK2 | Q16620 | 6/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | INSR | P06213 | 1/20 | 0.37 |
| ▸ | LYN | P07948 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.37 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | ROS1 | P08922 | 1/20 | 0.37 |
| ▸ | FGR | P09769 | 1/20 | 0.37 |
| ▸ | KIT | P10721 | 1/20 | 0.37 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.37 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.37 |
| ▸ | TIE1 | P35590 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18654799 | 0.89 | PIM1 (0.40) | PIM1NTRK1IRAK4NPC1RAB9A | |
| SCHEMBL18655107 | 0.87 | PIM1 (0.39) | PIM1NTRK1IRAK4 | |
| SCHEMBL14897321 | 0.80 | IRAK4 (0.51) | PIM1NTRK1NTRK3NTRK2JAK2 | |
| SCHEMBL20098872 | 0.78 | NTRK1 (0.39) | PIM1NTRK1NTRK3NTRK2RET | |
| SCHEMBL18654877 | 0.78 | PIM1 (0.36) | PIM1NTRK1NTRK3NTRK2IRAK4 | |
| SCHEMBL14897819 | 0.74 | IRAK4 (0.50) | NTRK1NTRK3NTRK2JAK2INSR | |
| SCHEMBL14881882 | 0.73 | IRAK4 (0.49) | PIM1NTRK1IRAK4NPC1RAB9A | |
| SCHEMBL14896935 | 0.72 | NTRK1 (0.46) | NTRK1NTRK3NTRK2RETKDR | |
| SCHEMBL14896861 | 0.71 | IRAK4 (0.50) | PIM1NTRK1NTRK3NTRK2IRAK4 | |
| SCHEMBL18655188 | 0.70 | MKNK1 (0.40) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2768509-B1 | SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2017-03-22 | — | — | EP | disclosed |