Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11273008 | 0.88 | ADORA2A (0.50) | ALDH1A1NPSR1HTTLMNAMEN1 | |
| SCHEMBL11268851 | 0.75 | SMN1; SMN2 (0.53) | ALDH1A1NPSR1LMNAMEN1KMT2A | |
| SCHEMBL22724721 | 0.75 | PAX8 (0.56) | ALDH1A1NPSR1HTTLMNAMEN1 | |
| SCHEMBL22724723 | 0.75 | PAX8 (0.56) | ALDH1A1NPSR1HTTLMNAMEN1 | |
| SCHEMBL11711628 | 0.74 | ALDH1A1 (0.51) | ALDH1A1NPSR1HTTLMNAMEN1 | |
| SCHEMBL7904930 | 0.73 | NPSR1 (1.00) | ALDH1A1NPSR1HTTLMNAMEN1 | |
| SCHEMBL20387001 | 0.73 | ALDH1A1 (1.00) | ALDH1A1NPSR1LMNAMEN1KMT2A | |
| Biphenyl SCHEMBL312988 | 0.72 | HTT (0.59) | ALDH1A1NPSR1HTTLMNAMEN1 | |
| SCHEMBL26867246 | 0.72 | TDP1 (0.79) | ALDH1A1MEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL16659834 | 0.72 | TDP1 (0.79) | ALDH1A1MEN1KMT2AMAPTSMN1; SMN2 |
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-4251527-A | ANTIINFLAMMATORY AGENTS | DIAMOND SHAMROCK CORPORATION (US) | 1981-02-17 | — | — | US | disclosed |