Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 1/20 | 0.56 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.56 |
| ▸ | SCN4A | P35499 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL6289867 | 0.97 | SOS1 (0.58) | SOS1HSPB1SCN4AGAALTA4H | |
| SCHEMBL6290683 | 0.97 | SOS1 (0.58) | SOS1HSPB1SCN4AGAALTA4H | |
| SCHEMBL351854 | 0.97 | SOS1 (0.58) | SOS1HSPB1SCN4AGAALTA4H | |
| SCHEMBL31655464 | 0.88 | SOS1 (0.52) | SOS1HSPB1SCN4AGAALTA4H | |
| SCHEMBL255272 | 0.85 | LTA4H (0.67) | SOS1HSPB1LTA4HMEN1KMT2A | |
| Phosphine SCHEMBL23466364 | 0.83 | LTA4H (0.63) | SOS1HSPB1LTA4HMEN1KMT2A | |
| SCHEMBL11508935 | 0.83 | SOS1 (0.48) | SOS1HSPB1SCN4AGAALTA4H | |
| SCHEMBL805908 | 0.83 | MAPT (0.58) | SOS1HSPB1SCN4AGAALTA4H | |
| SCHEMBL5175115 | 0.83 | MAOA (0.58) | SOS1HSPB1SCN4ALTA4HMEN1 | |
| Ammonia Solution, Strong SCHEMBL4263312 | 0.83 | LTA4H (0.63) | SOS1HSPB1LTA4HMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5773463-A | DECALCIFICATION OF BRAIN DISORDERS | SMITHKLINE BEECHAM P.L.C. (GB) | 1998-06-30 | — | — | US | disclosed |
| EP-0711272-A1 | INDANE AND TETRAHYDRONAPHTHALENE DERIVATIVES AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-05-15 | — | — | EP | disclosed |
| WO-1995004028-A1 | INDANE AND TETRAHYDRONAPHTHALENE DERIVATIVES AS CALCIUM CHANNEL ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-02-09 | — | — | WO | disclosed |