Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 11/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | XBP1 | P17861 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7704992 | 0.90 | ALDH1A1 (0.35) | CTSKSCN9AALDH1A1KDM4ERCE1 | |
| SCHEMBL7704912 | 0.88 | ALDH1A1 (0.45) | CTSSCTSKALDH1A1HPGDHTT | |
| SCHEMBL7713371 | 0.87 | NPSR1 (0.37) | ALDH1A1KDM4ERCE1HPGDHTT | |
| SCHEMBL7713363 | 0.87 | HPGD (0.41) | CTSSCTSKSCN9AALDH1A1KDM4E | |
| SCHEMBL7708356 | 0.86 | CTSS (0.41) | CTSSCTSKSCN9AALDH1A1HPGD | |
| SCHEMBL7711250 | 0.86 | ALDH1A1 (0.46) | CTSSCTSKSCN9AALDH1A1HPGD | |
| SCHEMBL7711369 | 0.84 | ALDH1A1 (0.37) | CTSSCTSKALDH1A1KDM4ERCE1 | |
| SCHEMBL7708019 | 0.84 | SMN1; SMN2 (0.42) | ALDH1A1KDM4ERCE1HPGDHTT | |
| SCHEMBL7708193 | 0.83 | ALDH1A1 (0.38) | CTSSCTSKALDH1A1KDM4ERCE1 | |
| SCHEMBL7704969 | 0.83 | ALDH1A1 (0.36) | ALDH1A1HPGDHTTNPSR1JAK2 |
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-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |