Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL20143907 | 0.95 | TSHR (0.40) | TSHR | |
| SCHEMBL20143910 | 0.91 | TSHR (0.37) | TSHR | |
| SCHEMBL18104281 | 0.89 | CYP2C19 (0.34) | TSHR | |
| SCHEMBL18104303 | 0.88 | TSHR (0.41) | TSHR | |
| SCHEMBL20143912 | 0.87 | TSHR (0.35) | TSHR | |
| SCHEMBL22356291 | 0.83 | TSHR (0.31) | TSHR | |
| SCHEMBL13322025 | 0.83 | TSHR (0.48) | TSHR | |
| SCHEMBL18104291 | 0.83 | ALDH1A1 (0.34) | TSHR | |
| SCHEMBL12225890 | 0.82 | MEN1 (0.35) | TSHR | |
| SCHEMBL16573897 | 0.81 | RAB9A (0.37) | TSHRCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-9972783-B2 | High energy triarylamine compounds for hole transport materials | E I DU PONT DE NEMOURS AND COMPANY (US) | 2018-05-15 | — | — | US | disclosed |