Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.66 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | F2 | P00734 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7307776 | 0.93 | ALDH1A1 (0.72) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL29513950 | 0.93 | ALDH1A1 (0.61) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL17056181 | 0.93 | ALDH1A1 (0.61) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL5173012 | 0.92 | ALDH1A1 (0.64) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL6508896 | 0.92 | ALDH1A1 (0.64) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL4366597 | 0.92 | ALDH1A1 (0.64) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL7314949 | 0.91 | ALDH1A1 (0.59) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL893264 | 0.87 | ALDH1A1 (0.54) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL17056182 | 0.87 | ALDH1A1 (0.54) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL29514072 | 0.87 | ALDH1A1 (0.54) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 |
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-6191146-B1 | BACTERICIDES, FUNGICIDES, VIRICIDES | SMITHKLINE BEECHAM CORPORATION | 2001-02-20 | — | — | US | disclosed |