Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 6/20 | 0.44 |
| ▸ | JAK2 | O60674 | 2/20 | 0.44 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.44 |
| ▸ | ABL1 | P00519 | 2/20 | 0.44 |
| ▸ | LCK | P06239 | 2/20 | 0.44 |
| ▸ | CSF1R | P07333 | 2/20 | 0.44 |
| ▸ | RET | P07949 | 2/20 | 0.44 |
| ▸ | MET | P08581 | 2/20 | 0.44 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.44 |
| ▸ | LTK | P29376 | 2/20 | 0.44 |
| ▸ | FLT3 | P36888 | 2/20 | 0.44 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.44 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.44 |
| ▸ | NTRK2 | Q16620 | 2/20 | 0.44 |
| ▸ | TAOK1 | Q7L7X3 | 2/20 | 0.44 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.44 |
| ▸ | MAP4K5 | Q9Y4K4 | 2/20 | 0.44 |
| ▸ | PLK4 | O00444 | 1/20 | 0.44 |
| ▸ | ROS1 | P08922 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL17969737 | 0.76 | ALK (0.41) | ALKJAK2PRKD3MAP4K4ABL1 | |
| SCHEMBL16615199 | 0.72 | ALK (0.61) | ALKJAK2PRKD3MAP4K4ABL1 | |
| SCHEMBL17969728 | 0.71 | ALK (0.49) | ALKJAK2PRKD3MAP4K4ABL1 | |
| SCHEMBL16615360 | 0.71 | ALK (0.57) | ALKJAK2PRKD3MAP4K4ABL1 | |
| SCHEMBL16615321 | 0.69 | ALK (0.48) | ALKJAK2PRKD3MAP4K4ABL1 | |
| SCHEMBL20859322 | 0.69 | ALK (0.47) | ALKJAK2PRKD3MAP4K4ABL1 | |
| SCHEMBL20859356 | 0.66 | ALK (0.41) | ALKJAK2PRKD3MAP4K4ABL1 | |
| SCHEMBL1600322 | 0.66 | ALK (0.69) | ALKJAK2PRKD3MAP4K4ABL1 | |
| SCHEMBL16615286 | 0.64 | ALK (0.49) | ALKJAK2PRKD3MAP4K4ABL1 | |
| SCHEMBL16615292 | 0.64 | ALK (0.46) | ALKJAK2PRKD3MAP4K4ABL1 |
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-3050884-A1 | NOVEL CHEMICAL COMPOUNDS (VARIANTS) AND THE USE THEREOF TO TREAT ONCOLOGICAL DISEASES | Limited Liability Company "National Pharmaceutical (RU) | 2016-08-03 | — | — | EP | disclosed |