Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 12/20 | 0.45 |
| ▸ | PARP10 | Q53GL7 | 3/20 | 0.35 |
| ▸ | PARP11 | Q9NR21 | 2/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13589774 | 0.78 | ALDH1A1 (0.50) | ALDH1A1GAAPARP1CDC7 | |
| SCHEMBL13189674 | 0.78 | ALDH1A1 (0.50) | ALDH1A1GAAPARP1PARP10ALOX5 | |
| SCHEMBL2485535 | 0.78 | ALDH1A1 (0.50) | ALDH1A1GAAPARP1CDC7 | |
| SCHEMBL13589780 | 0.78 | ALDH1A1 (0.50) | ALDH1A1GAAPARP1PARP10PARP11 | |
| SCHEMBL31750298 | 0.78 | ALDH1A1 (0.50) | ALDH1A1GAAPARP1PARP10CDC7 | |
| SCHEMBL10446487 | 0.75 | ALDH1A1 (0.47) | ALDH1A1GAAPARP1 | |
| SCHEMBL20100593 | 0.74 | ALDH1A1 (0.46) | ALDH1A1GAAPARP1 | |
| SCHEMBL30731345 | 0.74 | ALDH1A1 (0.46) | ALDH1A1GAAPARP1PARP10 | |
| SCHEMBL31728621 | 0.71 | ALDH1A1 (0.37) | ALDH1A1GAAPARP1PARP10PARP11 | |
| SCHEMBL20100677 | 0.70 | ALDH1A1 (0.43) | ALDH1A1GAAPARP1 |
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-2018079628-A1 | PYRROLE DERIVATIVE WITH FUSED RING AND PHARMACEUTICAL USE THEREOF | 大日本住友製薬株式会社 | 2018-05-03 | — | — | WO | disclosed |