Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.41 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL13622778 | 0.85 | ALDH1A1 (0.44) | ALDH1A1CYP1A2MEN1KMT2AHSD17B10 | |
| SCHEMBL24131085 | 0.85 | CYP1A2 (0.46) | ALDH1A1CYP1A2MEN1KMT2AHSD17B10 | |
| SCHEMBL5540834 | 0.84 | ALDH1A1 (0.46) | ALDH1A1CYP1A2MEN1KMT2AHSD17B10 | |
| SCHEMBL9586331 | 0.83 | GABRA1 (0.46) | ALDH1A1CYP1A2HSD17B10MAPK1GABRA1 | |
| SCHEMBL8692342 | 0.83 | ALDH1A1 (0.46) | ALDH1A1CYP1A2MEN1KMT2AHSD17B10 | |
| SCHEMBL16663609 | 0.83 | KDM4E (0.44) | ALDH1A1CYP1A2MEN1KMT2AHSD17B10 | |
| SCHEMBL4584766 | 0.82 | MAPT (0.45) | ALDH1A1MEN1KMT2AMAPK1GABRA2 | |
| SCHEMBL6559833 | 0.82 | TSHR (0.46) | ALDH1A1MEN1KMT2AMAPK1GAA | |
| SCHEMBL29897883 | 0.82 | TSHR (0.46) | ALDH1A1MEN1KMT2AMAPK1GAA | |
| SCHEMBL14895377 | 0.80 | RAB9A (0.42) | ALDH1A1CYP1A2MEN1KMT2AHSD17B10 |
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-2013060881-A1 | PYRIDOPYRIMIDINES AND THEIR THERAPEUTIC USE | VERENIGING VOOR CHRISTELIJK HOGER ONDERWIJS, WETENSCHAPPELIJK ONDERZOEK EN PATIENTENZORG (NL) | 2013-05-02 | — | — | WO | disclosed |