Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 4/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | MELK | Q14680 | 3/20 | 0.35 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL4586199 | 1.00 | GBA1 (0.39) | GBA1GLAALDH1A1HPGDTSHR | |
| Trifluoroacetic Acid SCHEMBL2988928 | 0.92 | GAA (0.43) | GBA1GLAMEN1KMT2AMAPT | |
| Trifluoroacetic Acid SCHEMBL5049855 | 0.92 | GAA (0.43) | GBA1GLAMEN1KMT2AMAPT | |
| SCHEMBL4586191 | 0.91 | ALDH1A1 (0.37) | GBA1GLAALDH1A1HPGDTSHR | |
| Trifluoroacetic Acid SCHEMBL4585816 | 0.89 | MEN1 (0.37) | GLAALDH1A1HPGDTSHREGFR | |
| Trifluoroacetic Acid SCHEMBL4585836 | 0.89 | MEN1 (0.37) | GLAALDH1A1HPGDTSHREGFR | |
| Trifluoroacetic Acid SCHEMBL2988931 | 0.88 | GBA1 (0.39) | GBA1GLAALDH1A1HPGDTSHR | |
| SCHEMBL2993692 | 0.84 | ALDH1A1 (0.46) | GBA1GLAALDH1A1HPGDTSHR | |
| SCHEMBL2993695 | 0.84 | ALDH1A1 (0.46) | GBA1GLAALDH1A1HPGDTSHR | |
| Trifluoroacetic Acid SCHEMBL4585467 | 0.83 | EGFR (0.35) | EGFRMEN1KMT2AMAPTESR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1879563-A4 | NOVEL CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORP (US) | 2008-07-16 | — | — | EP | disclosed |
| EP-1879563-A2 | NOVEL CHEMICAL COMPOUNDS | Smithkline Beecham Corporation (US) | 2008-01-23 | — | — | EP | disclosed |
| WO-2006132739-A2 | NOVEL CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-12-14 | — | — | WO | disclosed |