Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 11/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.60 |
| ▸ | POLB | P06746 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | PKM | P14618 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | APP | P05067 | 1/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL22725430 | 0.88 | MAPT (0.61) | ALDH1A1NPSR1MAPTL3MBTL1TDP1 | |
| SCHEMBL5149985 | 0.83 | ALDH1A1 (0.67) | ALDH1A1NPSR1MAPTL3MBTL1TDP1 | |
| SCHEMBL10935716 | 0.82 | ALDH1A1 (0.66) | ALDH1A1NPSR1MAPTL3MBTL1TDP1 | |
| SCHEMBL8509662 | 0.79 | MEN1 (0.60) | ALDH1A1MAPTL3MBTL1TDP1POLB | |
| SCHEMBL6044645 | 0.78 | HCAR3 (0.72) | MAPTMEN1KMT2A | |
| SCHEMBL25139738 | 0.77 | ALDH1A1 (0.53) | ALDH1A1NPSR1MAPTL3MBTL1TDP1 | |
| SCHEMBL1982270 | 0.77 | L3MBTL1 (0.61) | ALDH1A1NPSR1MAPTL3MBTL1TDP1 | |
| SCHEMBL9683242 | 0.77 | MAPT (0.84) | ALDH1A1NPSR1MAPTL3MBTL1TDP1 | |
| SCHEMBL112296 | 0.77 | ALDH1A1 (0.68) | ALDH1A1NPSR1MAPTL3MBTL1TDP1 | |
| SCHEMBL8610624 | 0.77 | ALDH1A1 (0.59) | ALDH1A1NPSR1MAPTL3MBTL1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5852017-A | 2,3(1H,4H)-quinoxalinediones | BASF AKTIENGESELLSCHAFT (DE) | 1998-12-22 | — | — | US | disclosed |
| US-5714489-A | 2,3(1H,4H)quinoxalinedione | BASF AKTIENGESELLSCHAFT (DE) | 1998-02-03 | — | — | US | disclosed |
| EP-0572852-A1 | Quinoxalin-2,3(1H,4H)-diones used as medicine | BASF Aktiengesellschaft (DE) | 1993-12-08 | — | — | EP | disclosed |