Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CASP2 | P42575 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA3 | P07451 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8088030 | 0.98 | GBA1 (0.50) | GBA1TSHRALDH1A1SMN1; SMN2POLB | |
| SCHEMBL31218391 | 0.86 | GBA1 (0.39) | GBA1TSHRALDH1A1SMN1; SMN2POLB | |
| SCHEMBL6027301 | 0.84 | GBA1 (0.40) | GBA1ALDH1A1SMN1; SMN2POLBMEN1 | |
| SCHEMBL6027767 | 0.84 | GBA1 (0.40) | GBA1ALDH1A1SMN1; SMN2POLBMEN1 | |
| SCHEMBL1234893 | 0.84 | GBA1 (0.44) | GBA1ALDH1A1CA12CA2CA3 | |
| SCHEMBL10046572 | 0.84 | GBA1 (0.44) | GBA1TSHRCASP2MEN1KMT2A | |
| SCHEMBL1235601 | 0.84 | GBA1 (0.44) | GBA1ALDH1A1CA12CA2CA3 | |
| SCHEMBL1234763 | 0.84 | GBA1 (0.44) | GBA1ALDH1A1CA12CA2CA3 | |
| SCHEMBL15625533 | 0.83 | GBA1 (0.43) | GBA1TSHRPOLBCASP2NAAA | |
| SCHEMBL13063698 | 0.82 | CASP2 (0.56) | GBA1ALDH1A1SMN1; SMN2CASP2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6054615-A | Fluorinated quaternary ammonium salts | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-04-25 | — | — | US | disclosed |