Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 7/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7455524 | 0.84 | ALDH1A1 (0.46) | ANPEPMMP3LMNAALDH1A1TP53 | |
| SCHEMBL8044575 | 0.83 | CAPN1 (0.41) | ANPEPMMP3LMNAMAPK1 | |
| SCHEMBL7642642 | 0.77 | ALDH1A1 (0.40) | LMNASMN1; SMN2NPC1ALDH1A1TP53 | |
| SCHEMBL7406417 | 0.74 | ALDH1A1 (0.37) | LMNASMN1; SMN2NPC1ALDH1A1TP53 | |
| Proline SCHEMBL7402744 | 0.72 | ALDH1A1 (0.36) | MMP3LMNAALDH1A1MAPTMAPK1 | |
| SCHEMBL7442154 | 0.71 | CYP2C9 (0.43) | — | |
| SCHEMBL7402896 | 0.71 | ALDH1A1 (0.36) | MMP3LMNAALDH1A1MAPTMAPK1 | |
| Proline SCHEMBL7402894 | 0.71 | SMN1; SMN2 (0.39) | MMP3SMN1; SMN2 | |
| SCHEMBL7397791 | 0.70 | SMN1; SMN2 (0.34) | LMNASMN1; SMN2NPC1ALDH1A1TP53 | |
| SCHEMBL22436168 | 0.68 | ADORA3 (0.40) | SMN1; SMN2NPC1TP53MAPTRAB9A |
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-6114537-A | 1,2,4-THIADIAZOLE COMPOUND IS USEFUL FOR TRAPPING THIOL COMPOUNDS AND SELECTIVELY CHANGING THIOLS TO DISULFIDE COMPOUNDS | APOTEX INC. (CA) | 2000-09-05 | — | — | US | disclosed |