Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.64 |
| ▸ | GAA | P10253 | 3/20 | 0.64 |
| ▸ | PKM | P14618 | 3/20 | 0.64 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | GLA | P06280 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.37 |
| ▸ | CGAS | Q8N884 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9387073 | 0.80 | KDM4E (0.55) | KDM4EALDH1A1GAAPKMHPGD | |
| SCHEMBL9388014 | 0.79 | KDM4E (0.56) | KDM4EALDH1A1GAAPKMHPGD | |
| SCHEMBL9383435 | 0.79 | ALDH1A1 (0.49) | KDM4EALDH1A1GAAPKMHPGD | |
| SCHEMBL5717801 | 0.78 | ALDH1A1 (1.00) | KDM4EALDH1A1GAAPKMHPGD | |
| SCHEMBL9383229 | 0.78 | ALDH1A1 (0.49) | KDM4EALDH1A1GAAPKMHPGD | |
| SCHEMBL22271486 | 0.76 | KDM4E (0.66) | KDM4EALDH1A1GAAPKMHPGD | |
| SCHEMBL5912239 | 0.74 | ALDH1A1 (0.76) | KDM4EALDH1A1GAAPKMHPGD | |
| SCHEMBL14740159 | 0.73 | KDM4E (0.66) | KDM4EALDH1A1GAAPKMHPGD | |
| SCHEMBL9389118 | 0.72 | TP53 (0.50) | KDM4EALDH1A1GAAHPGDMAPT | |
| SCHEMBL9382960 | 0.70 | HTT (0.42) | KDM4EALDH1A1GAAPKMHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0326981-B1 | 4-Oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide derivatives, their preparation, medicaments containing them and their preparation | CHINOIN GYOGYSZER ES VEGYESZET (HU) | 1994-11-09 | — | — | EP | disclosed |
| EP-0326981-A2 | 4-Oxo-4H-pyrido[1,2-a]pyrimidine-3-carboxamide derivatives, their preparation, medicaments containing them and their preparation | CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) | 1989-08-09 | — | — | EP | disclosed |