Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GNAI3 | P08754 | 1/20 | 0.34 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.34 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3815697 | 0.85 | SLC6A4 (0.41) | GNAI3GNAO1GNAI1SIGMAR1SLC6A2 | |
| SCHEMBL21574389 | 0.78 | SIGMAR1 (0.43) | GNAI3GNAO1GNAI1SIGMAR1SLC6A2 | |
| SCHEMBL23956553 | 0.77 | SLC6A4 (0.39) | GNAI3GNAO1GNAI1SIGMAR1SLC6A2 | |
| SCHEMBL24700238 | 0.77 | — | — | |
| SCHEMBL27883571 | 0.77 | SIGMAR1 (0.36) | GNAI3GNAO1GNAI1SIGMAR1SLC6A2 | |
| SCHEMBL22702328 | 0.74 | GNAO1 (0.42) | GNAI3GNAO1GNAI1SIGMAR1SLC6A2 | |
| SCHEMBL14976680 | 0.74 | SIGMAR1 (0.37) | GNAI3GNAO1GNAI1SIGMAR1SLC6A2 | |
| SCHEMBL4308594 | 0.74 | SIGMAR1 (0.45) | GNAI3GNAO1GNAI1SIGMAR1SLC6A2 | |
| SCHEMBL23543146 | 0.73 | MAPT (0.42) | SLC6A2SLC6A4SLC6A3OPRD1 | |
| SCHEMBL22702329 | 0.73 | SIGMAR1 (0.42) | GNAI3GNAO1GNAI1SIGMAR1SLC6A2 |
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-2023287130-A1 | NOVEL PYRIMIDINE-2,4-DIAMINE DERIVATIVES, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF CANCER | 한국화학연구원 | 2023-01-19 | — | — | WO | disclosed |