Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 5/20 | 0.41 |
| ▸ | CSNK2A1 | P68400 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MAP2K4 | P45985 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | MAPK6 | Q16659 | 1/20 | 0.35 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.35 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4055439 | 0.94 | PARP1 (0.42) | PARP1CSNK2A1KDM4ERECQLALDH1A1 | |
| SCHEMBL4719982 | 0.86 | ALDH1A1 (0.40) | PARP1CSNK2A1KDM4EALDH1A1DYRK1B | |
| SCHEMBL2459129 | 0.83 | PARP1 (0.54) | PARP1CSNK2A1KDM4ERECQLALDH1A1 | |
| SCHEMBL10508693 | 0.77 | PARP1 (0.48) | PARP1CSNK2A1KDM4ERECQLALDH1A1 | |
| SCHEMBL2462240 | 0.76 | PARP1 (0.45) | PARP1CSNK2A1KDM4ERECQLLMNA | |
| SCHEMBL2463004 | 0.76 | MAP2K4 (0.44) | PARP1CSNK2A1KDM4ERECQLALDH1A1 | |
| SCHEMBL2463881 | 0.76 | PARP1 (0.45) | PARP1CSNK2A1KDM4ERECQLALDH1A1 | |
| SCHEMBL31523324 | 0.75 | MAP2K4 (0.50) | PARP1CSNK2A1KDM4EALDH1A1DYRK1B | |
| SCHEMBL9818232 | 0.75 | MAP2K4 (0.50) | PARP1CSNK2A1KDM4EALDH1A1DYRK1B | |
| SCHEMBL10702355 | 0.74 | TSHR (0.42) | PARP1KDM4ERECQLALDH1A1CA1 |
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 |