Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | XIAP | P98170 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 7/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | ADK | P55263 | 1/20 | 0.38 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 1/20 | 0.38 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPY1R | P25929 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8604042 | 0.93 | ALDH1A1 (0.47) | TSHRALDH1A1SMN1; SMN2XIAPTP53 | |
| SCHEMBL8604584 | 0.92 | KDM4E (0.45) | TSHRALDH1A1SMN1; SMN2XIAPTP53 | |
| SCHEMBL8599845 | 0.90 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2XIAPTP53 | |
| SCHEMBL8555175 | 0.89 | FAAH (0.50) | TSHRALDH1A1SMN1; SMN2FAAHXIAP | |
| SCHEMBL8602935 | 0.88 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2TP53PPARG | |
| SCHEMBL8601638 | 0.86 | TSHR (0.44) | TSHRALDH1A1SMN1; SMN2FAAHXIAP | |
| SCHEMBL8603793 | 0.85 | ALDH1A1 (0.45) | TSHRALDH1A1SMN1; SMN2XIAPTP53 | |
| SCHEMBL8602959 | 0.84 | TSHR (0.44) | TSHRPPARG | |
| SCHEMBL8554618 | 0.83 | KDM4E (0.41) | TSHRALDH1A1SMN1; SMN2TP53KDM4E | |
| SCHEMBL8553542 | 0.83 | TSHR (0.49) | TSHRALDH1A1SMN1; SMN2XIAPPPARG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5854242-A | Benzoxazine antimicrobial agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1998-12-29 | — | — | US | disclosed |
| US-5696117-A | BACTERICIDE | ORTHO PHARMACEUTICAL CORPORATION (US) | 1997-12-09 | — | — | US | disclosed |