Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.33 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | KLK1 | P06870 | 1/20 | 0.33 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1194126 | 0.99 | MAPK8 (0.38) | MAPK8KMT2AAPOBEC3AAPOBEC3GCYP3A4 | |
| SCHEMBL6599056 | 0.89 | CYP3A4 (0.39) | MAPK8KMT2AAPOBEC3AAPOBEC3GCYP3A4 | |
| Hydrochloric Acid SCHEMBL1195003 | 0.88 | CYP3A4 (0.39) | MAPK8KMT2AAPOBEC3AAPOBEC3GCYP3A4 | |
| SCHEMBL6598418 | 0.87 | KMT2A (0.36) | MAPK8KMT2AAPOBEC3AAPOBEC3GCYP3A4 | |
| Hydrochloric Acid SCHEMBL5364641 | 0.87 | KMT2A (0.35) | MAPK8KMT2AAPOBEC3AAPOBEC3GCYP3A4 | |
| Bromide SCHEMBL1194131 | 0.87 | KMT2A (0.35) | MAPK8KMT2AAPOBEC3AAPOBEC3GCYP3A4 | |
| Hydrochloric Acid SCHEMBL7068569 | 0.86 | KMT2A (0.35) | KMT2AAPOBEC3AAPOBEC3GRAB9AALDH1A1 | |
| SCHEMBL6598021 | 0.82 | KMT2A (0.45) | KMT2AAPOBEC3AAPOBEC3GCYP2C19RAB9A | |
| SCHEMBL6597984 | 0.82 | MAPK8 (0.39) | MAPK8KMT2AMEN1ALDH1A1ROCK2 | |
| Hydrochloric Acid SCHEMBL1193657 | 0.81 | KMT2A (0.44) | KMT2AAPOBEC3AAPOBEC3GCYP2C19RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1373263-B1 | HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS | TORRENT PHARMACEUTICALS LTD (IN) | 2004-10-27 | — | — | EP | claimed |