Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | ADK | P55263 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 11/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8555504 | 0.91 | TSHR (0.41) | TSHRTP53ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL8603405 | 0.91 | TSHR (0.42) | TSHRTP53ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL8553976 | 0.91 | KMT2A (0.48) | TSHRTP53ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL8602122 | 0.91 | TSHR (0.44) | TSHRTP53ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL8604038 | 0.90 | TP53 (0.42) | TSHRTP53ALDH1A1SMN1; SMN2GSK3B | |
| SCHEMBL8555600 | 0.88 | SIRT2 (0.43) | TSHRTP53ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL7475653 | 0.88 | ALDH1A1 (0.42) | TSHRTP53ALDH1A1SMN1; SMN2GSK3B | |
| SCHEMBL8595844 | 0.88 | TSHR (0.45) | TSHRTP53ALDH1A1SMN1; SMN2PPARG | |
| SCHEMBL8557727 | 0.88 | GSK3B (0.47) | TSHRTP53ALDH1A1SMN1; SMN2GSK3B | |
| SCHEMBL8604494 | 0.88 | ALDH1A1 (0.43) | TSHRTP53ALDH1A1SMN1; SMN2GSK3B |
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 |