Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.47 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.44 |
| ▸ | TNKS | O95271 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDR | P35968 | 2/20 | 0.42 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | PI4KA | P42356 | 1/20 | 0.40 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.40 |
| ▸ | RAF1 | P04049 | 4/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.39 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.39 |
| ▸ | PARP6 | Q2NL67 | 2/20 | 0.39 |
| ▸ | PARP3 | Q9Y6F1 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1584750 | 0.81 | MAPK1 (0.54) | PARP1ALDH1A1HIF1AP4HTMKDM4E | |
| SCHEMBL1584427 | 0.80 | P4HTM (0.61) | ALDH1A1HIF1AP4HTMKDM4EMEN1 | |
| SCHEMBL30027907 | 0.80 | PARP1 (0.51) | PARP1ALDH1A1PIP5K1CPIK3CAPI4KA | |
| SCHEMBL26970993 | 0.80 | PARP1 (0.51) | PARP1ALDH1A1PIP5K1CPIK3CAPI4KA | |
| SCHEMBL16597438 | 0.80 | PARP1 (0.51) | PARP1ALDH1A1PIP5K1CPIK3CAPI4KA | |
| SCHEMBL12561176 | 0.80 | PLK1 (0.55) | PARP1PARP2KCNH2ALDH1A1PIP5K1C | |
| SCHEMBL2642500 | 0.79 | PARP1 (0.50) | PARP1ALDH1A1KDRPIP5K1CPIK3CA | |
| SCHEMBL2642502 | 0.79 | PARP1 (0.50) | PARP1ALDH1A1PIP5K1CPIK3CAPI4KA | |
| SCHEMBL26970992 | 0.79 | PARP1 (0.50) | PARP1ALDH1A1PIP5K1CPIK3CAPI4KA | |
| SCHEMBL17091441 | 0.78 | PARP1 (0.47) | PARP1ALDH1A1HIF1AP4HTMKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-108137513-A | Pyrimidine derivatives | ASKA 制药株式会社 | 2018-06-08 | — | — | CN | disclosed |