Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | HRH2 | P25021 | 2/20 | 0.47 |
| ▸ | HRH1 | P35367 | 2/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | COPS5 | Q92905 | 2/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL34467505 | 0.98 | ALDH1A1 (0.55) | ALDH1A1HSD17B10HTTHRH2HRH1 | |
| SCHEMBL31635679 | 0.86 | ALDH1A1 (0.58) | ALDH1A1HSD17B10HRH2HRH1HRH4 | |
| SCHEMBL16476545 | 0.83 | ALDH1A1 (0.56) | ALDH1A1HSD17B10HTTHRH2HRH1 | |
| SCHEMBL4015118 | 0.83 | ALDH1A1 (0.56) | ALDH1A1HSD17B10HRH2HRH1HRH4 | |
| SCHEMBL4107856 | 0.83 | ALDH1A1 (0.55) | ALDH1A1HSD17B10HRH2HRH1HRH4 | |
| SCHEMBL3979700 | 0.83 | ALDH1A1 (0.59) | ALDH1A1HSD17B10HTTHRH2HRH1 | |
| SCHEMBL31635695 | 0.82 | ALDH1A1 (0.55) | ALDH1A1HSD17B10HTTHRH2HRH1 | |
| SCHEMBL34467412 | 0.80 | ALDH1A1 (0.50) | ALDH1A1HSD17B10HTTCOPS5HSP90AB1 | |
| SCHEMBL27771626 | 0.80 | COPS5 (0.49) | ALDH1A1HSD17B10HTTHRH1COPS5 | |
| SCHEMBL13845010 | 0.80 | ALDH1A1 (0.52) | ALDH1A1HSD17B10HRH2HRH1HRH4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009056556-A1 | SUBSTITUTE 1, 6-NAPHTHYRIDINES FOR USE AS SCD INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-05-07 | — | — | WO | disclosed |
| WO-2009056556-A1 | SUBSTITUTE 1, 6-NAPHTHYRIDINES FOR USE AS SCD INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-05-07 | — | — | WO | disclosed |