Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 17/20 | 1.00 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.74 |
| ▸ | DHODH | Q02127 | 2/20 | 0.43 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.41 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7111338 | 0.89 | PARP1 (0.80) | PARP1PARP2DHODHPKN1PKN2 | |
| SCHEMBL7045309 | 0.88 | PARP1 (0.78) | PARP1PARP2DHODH | |
| SCHEMBL31602072 | 0.88 | PARP1 (0.81) | PARP1PARP2DHODHNPC1RAB9A | |
| SCHEMBL424209 | 0.88 | PARP1 (0.81) | PARP1PARP2DHODHNPC1RAB9A | |
| SCHEMBL7042977 | 0.88 | PARP1 (0.78) | PARP1PARP2DHODH | |
| SCHEMBL7108289 | 0.85 | PARP1 (1.00) | PARP1PARP2 | |
| SCHEMBL7045177 | 0.84 | PARP1 (1.00) | PARP1PARP2NPC1RAB9A | |
| SCHEMBL7107333 | 0.84 | PARP1 (1.00) | PARP1PARP2 | |
| SCHEMBL7043497 | 0.83 | PARP1 (0.71) | PARP1PARP2DHODHPKN1PKN2 | |
| SCHEMBL7042013 | 0.83 | PARP1 (0.71) | PARP1PARP2NPC1RAB9A |
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-2003007959-A1 | QUINOXALINE DERIVATIVES WHICH HAVE PARP INHIBITORY ACTION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2003-01-30 | — | — | WO | disclosed |