Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 5/20 | 0.61 |
| ▸ | ROS1 | P08922 | 2/20 | 0.61 |
| ▸ | EGFR | P00533 | 15/20 | 0.59 |
| ▸ | MET | P08581 | 1/20 | 0.57 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.55 |
| ▸ | INSR | P06213 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL24565253 | 0.90 | ALK (0.62) | ALKEGFRINSR | |
| SCHEMBL1707766 | 0.89 | EGFR (0.61) | ALKROS1EGFRMETLRRK2 | |
| SCHEMBL24565260 | 0.89 | EGFR (0.58) | ALKROS1EGFRMETLRRK2 | |
| SCHEMBL24565334 | 0.88 | EGFR (0.57) | ALKROS1EGFRMETLRRK2 | |
| SCHEMBL9911236 | 0.88 | EGFR (0.64) | ALKROS1EGFRMETLRRK2 | |
| Hydrochloric Acid SCHEMBL1707842 | 0.87 | EGFR (0.63) | ALKROS1EGFRMETLRRK2 | |
| SCHEMBL24565264 | 0.87 | EGFR (0.56) | ALKROS1EGFRMETLRRK2 | |
| SCHEMBL24565479 | 0.86 | ROS1 (0.59) | ALKROS1EGFRMETLRRK2 | |
| SCHEMBL24565276 | 0.86 | ALK (0.61) | ALKROS1EGFRMET | |
| SCHEMBL24565201 | 0.83 | ROS1 (0.59) | ALKROS1EGFRMETLRRK2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022139386-A1 | HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF | 주식회사 비투에스바이오 | 2022-06-30 | — | — | WO | disclosed |