Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.44 |
| ▸ | PLA2G7 | Q13093 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 2/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | PNP | P00491 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | VKORC1 | Q9BQB6 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1888814 | 0.82 | ALDH1A1 (0.60) | ALDH1A1NPSR1LMNAKDM4ENPC1 | |
| SCHEMBL20828264 | 0.77 | ALDH1A1 (0.59) | ALDH1A1NPSR1LMNAKDM4ENPC1 | |
| SCHEMBL7007907 | 0.76 | PNP (0.55) | PLA2G7HRH4HRH3PNP | |
| SCHEMBL11448238 | 0.74 | ALDH1A1 (0.61) | ALDH1A1NPSR1LMNAKDM4ENPC1 | |
| SCHEMBL3810225 | 0.74 | ALDH1A1 (0.61) | ALDH1A1NPSR1LMNAKDM4ENPC1 | |
| SCHEMBL10736202 | 0.72 | GFER (0.57) | ALDH1A1LMNAPLA2G7KDM4EGFER | |
| SCHEMBL11449106 | 0.72 | ALDH1A1 (0.65) | ALDH1A1NPSR1LMNAKDM4ENPC1 | |
| SCHEMBL14123294 | 0.71 | SMN1; SMN2 (0.68) | ALDH1A1TBXAS1PLA2G7HRH4HRH3 | |
| SCHEMBL20828263 | 0.71 | ALDH1A1 (0.70) | ALDH1A1NPSR1LMNAKDM4ENPC1 | |
| SCHEMBL10806849 | 0.71 | ATM (0.54) | ALDH1A1NPSR1LMNAKDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-4216318-A | HISTAMINE HZ-ANTAGONISTS, ISOCYTOSINES | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1980-08-05 | — | — | US | disclosed |
| US-4154834-A | HETEROCYCLIC-(THIO)ALKYLAMINO SUBSTITUTED-4-PYRIMIDONE OR -THIONES | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1979-05-15 | — | — | US | disclosed |