Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 3/20 | 0.40 |
| ▸ | CTSK | P43235 | 3/20 | 0.40 |
| ▸ | ECE1 | P42892 | 2/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | RPA1 | P27694 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ICMT | O60725 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | BCL2 | P10415 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6500000 | 1.00 | SERPINE1 (0.41) | SERPINE1CTSSCTSKECE1EGFR | |
| SCHEMBL6503401 | 0.87 | CTSS (0.41) | CTSSCTSKECE1EGFRAURKB | |
| SCHEMBL6503403 | 0.87 | CTSS (0.41) | CTSSCTSKECE1EGFRAURKB | |
| SCHEMBL5693088 | 0.80 | MCHR1 (0.41) | SERPINE1EGFRAURKBNR1H4APP | |
| SCHEMBL3995348 | 0.80 | CTSS (0.50) | CTSSCTSKECE1HDAC1CTSB | |
| SCHEMBL5693123 | 0.80 | MCHR1 (0.42) | SERPINE1EGFRAURKBAPPLMNA | |
| SCHEMBL3995503 | 0.79 | ATM (0.43) | CTSSCTSKECE1NR1H4RPA1 | |
| SCHEMBL4824319 | 0.79 | ATM (0.43) | CTSSCTSKECE1NR1H4RPA1 | |
| SCHEMBL3992019 | 0.79 | ATM (0.45) | CTSSCTSKECE1AURKBMMP2 | |
| SCHEMBL3992025 | 0.79 | ATM (0.45) | CTSSCTSKECE1AURKBMMP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005014534-A1 | ARYL AND HETEROARYL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | TRANSTECH PHARMA, INC. (US) | 2005-02-17 | — | — | WO | disclosed |