Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
| ▸ | COPS5 | Q92905 | 2/20 | 0.49 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.43 |
| ▸ | PPARD | Q03181 | 4/20 | 0.43 |
| ▸ | PPARA | Q07869 | 4/20 | 0.43 |
| ▸ | PPARG | P37231 | 3/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | SCN4A | P35499 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 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 | |
|---|---|---|---|---|
| SCHEMBL13844980 | 0.84 | PPARD (0.44) | ALDH1A1LTA4HMBOAT4NPC1GAA | |
| SCHEMBL4552621 | 0.83 | GPR52 (0.53) | ALDH1A1HSD17B10LTA4HCYP1A2 | |
| SCHEMBL4015118 | 0.83 | ALDH1A1 (0.56) | ALDH1A1HSD17B10COPS5NPC1GAA | |
| SCHEMBL31635679 | 0.82 | ALDH1A1 (0.58) | ALDH1A1HSD17B10LTA4HCOPS5NPC1 | |
| SCHEMBL16476545 | 0.80 | ALDH1A1 (0.56) | ALDH1A1HSD17B10COPS5NPC1GAA | |
| SCHEMBL3987419 | 0.80 | ALDH1A1 (0.56) | ALDH1A1HSD17B10COPS5NPC1GAA | |
| SCHEMBL4107856 | 0.79 | ALDH1A1 (0.55) | ALDH1A1HSD17B10LTA4HCOPS5GAA | |
| Hydrochloric Acid SCHEMBL34467505 | 0.78 | ALDH1A1 (0.55) | ALDH1A1HSD17B10COPS5NPC1GAA | |
| SCHEMBL9427047 | 0.74 | ALDH1A1 (0.50) | ALDH1A1HSD17B10COPS5NPC1GAA | |
| SCHEMBL3979700 | 0.73 | ALDH1A1 (0.59) | ALDH1A1HSD17B10COPS5CYP1A2HRH2 |
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-2009056556-A1 | SUBSTITUTE 1, 6-NAPHTHYRIDINES FOR USE AS SCD INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-05-07 | — | — | WO | disclosed |