Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.33 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | PAK4 | O96013 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 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 | |
|---|---|---|---|---|
| SCHEMBL4719979 | 0.86 | PARP1 (0.41) | ALDH1A1MAPK1KDM4EPOLBPARP1 | |
| SCHEMBL4058183 | 0.80 | KDM4E (0.55) | ALDH1A1MAPK1L3MBTL1KDM4EKMT2A | |
| SCHEMBL4055439 | 0.80 | PARP1 (0.42) | ALDH1A1MAPK1KDM4EPARP1HPGD | |
| SCHEMBL4718015 | 0.69 | SYK (0.49) | ALDH1A1MAPK1L3MBTL1KDM4EKMT2A | |
| SCHEMBL4060640 | 0.69 | ATM (0.57) | ALDH1A1L3MBTL1KDM4EPOLBPARP1 | |
| SCHEMBL29348065 | 0.68 | PARP1 (0.47) | ALDH1A1KMT2APARP1CHEK1ROCK1 | |
| SCHEMBL30319406 | 0.68 | DAO (0.42) | ALDH1A1KDM4EPOLBPARP1 | |
| SCHEMBL24076903 | 0.68 | PRMT5 (0.48) | ALDH1A1L3MBTL1METAP2CHEK1AURKA | |
| SCHEMBL2459129 | 0.67 | PARP1 (0.54) | ALDH1A1L3MBTL1KDM4EPOLBPARP1 | |
| SCHEMBL10508693 | 0.66 | PARP1 (0.48) | ALDH1A1L3MBTL1KDM4EKMT2APOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1999127-A1 | PHTHALAZINONE PYRAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F.HOFFMANN-LA ROCHE AG (CH) | 2008-12-10 | — | — | EP | disclosed |
| WO-2007107298-A1 | PHTHALAZINONE PYRAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-09-27 | — | — | WO | disclosed |