Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.48 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.43 |
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 SCHEMBL6789970 | 0.99 | PARP1 (0.51) | PARP1ROCK2ROCK1KDM4EALDH1A1 | |
| SCHEMBL6785898 | 0.93 | PARP1 (0.53) | PARP1ROCK2ROCK1KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL6788164 | 0.93 | PARP1 (0.52) | PARP1ROCK2ROCK1KDM4EALDH1A1 | |
| SCHEMBL6783127 | 0.91 | PARP1 (0.48) | PARP1ROCK2ROCK1KDM4EALDH1A1 | |
| SCHEMBL6786446 | 0.91 | PARP1 (0.52) | PARP1ROCK2ROCK1KDM4EALDH1A1 | |
| SCHEMBL6788972 | 0.91 | PARP1 (0.52) | PARP1ROCK2ROCK1KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL6793382 | 0.91 | PARP1 (0.48) | PARP1ROCK2ROCK1KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL6783110 | 0.90 | PARP1 (0.52) | PARP1ROCK2ROCK1KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL6788906 | 0.90 | PARP1 (0.51) | PARP1ROCK2ROCK1KDM4EALDH1A1 | |
| SCHEMBL6793417 | 0.90 | PARP1 (0.51) | PARP1ROCK2ROCK1HDAC1HDAC6 |
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-6677333-B1 | ANTIISCHEMIC AGENTS; BRAIN, CARDIOVASCULAR, MUSCULAR, AND GASTROINTESTINAL DISORDERS; ANALGESICS, ANTIDIABETIC AGENTS; RETROVIRUS SENSITIZERS; ALZHEIMER*S DISEASE | ONO PHARMACEUTICAL CO., LTD. (JP) | 2004-01-13 | — | — | US | claimed |
| EP-1148053-A1 | 2H-PHTHALAZIN-1-ONE DERIVATIVES AND DRUGS COMPRISING THESE DERIVATIVES AS THE ACTIVE INGREDIENT | ONO PHARMACEUTICAL CO., LTD. (JP) | 2001-10-24 | — | — | EP | claimed |