Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.39 |
| ▸ | PDE2A | O00408 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL8296809 | 0.84 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2APOLBPKM | |
| SCHEMBL8291560 | 0.75 | MAPT (0.57) | ALDH1A1MEN1KMT2APOLBCYP3A4 | |
| SCHEMBL8292026 | 0.75 | MAPT (0.44) | ALDH1A1MEN1KMT2APOLBPKM | |
| SCHEMBL29451638 | 0.74 | ALDH1A1 (0.59) | ALDH1A1MEN1KMT2APOLBPKM | |
| SCHEMBL7212568 | 0.74 | ALDH1A1 (0.59) | ALDH1A1MEN1KMT2APOLBPKM | |
| SCHEMBL8298291 | 0.73 | ALDH1A1 (0.64) | ALDH1A1MEN1KMT2APOLBPKM | |
| SCHEMBL8296403 | 0.72 | ALDH1A1 (0.42) | ALDH1A1MEN1KMT2APOLBPKM | |
| SCHEMBL8291563 | 0.72 | MAPT (0.41) | ALDH1A1MEN1KMT2APOLBHTT | |
| SCHEMBL8437635 | 0.70 | PKM (0.38) | ALDH1A1POLBPKMKDM4ELMNA | |
| SCHEMBL8291585 | 0.70 | CA12 (0.37) | ALDH1A1POLBPKMCYP3A4CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0676397-B1 | Oxopyridinylquinoxaline derivatives | SHIONOGI & CO (JP) | 1999-10-20 | — | — | EP | disclosed |
| US-5677305-A | NERVOUS SYSTEM DISORDERS | SHIONOGI & CO., LTD. (JP) | 1997-10-14 | — | — | US | disclosed |
| EP-0676397-A1 | Oxopyridinylquinoxaline derivatives | SHIONOGI & CO., LTD. (JP) | 1995-10-11 | — | — | EP | disclosed |