Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 7/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.64 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | EYA3 | Q99504 | 5/20 | 0.54 |
| ▸ | MEN1 | O00255 | 5/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.51 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.51 |
| ▸ | AR | P10275 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11672853 | 0.87 | L3MBTL1 (0.56) | CYP2C19CYP2C9L3MBTL1EYA3MEN1 | |
| SCHEMBL11672097 | 0.86 | CYP2C19 (0.67) | CYP2C19CYP2C9L3MBTL1MEN1KMT2A | |
| SCHEMBL11727292 | 0.84 | L3MBTL1 (0.56) | CYP2C19CYP2C9L3MBTL1EYA3MEN1 | |
| SCHEMBL11181979 | 0.84 | CYP2C19 (0.67) | CYP2C19CYP2C9L3MBTL1EYA3MEN1 | |
| SCHEMBL11674647 | 0.83 | L3MBTL1 (0.52) | CYP2C19CYP2C9L3MBTL1EYA3MEN1 | |
| SCHEMBL7068281 | 0.82 | L3MBTL1 (0.67) | CYP2C19L3MBTL1EYA3MEN1KMT2A | |
| SCHEMBL11673907 | 0.81 | L3MBTL1 (0.62) | CYP2C19L3MBTL1KDM4ELMNAALDH1A1 | |
| SCHEMBL11672355 | 0.80 | L3MBTL1 (0.64) | CYP2C19CYP2C9L3MBTL1EYA3MEN1 | |
| SCHEMBL11728862 | 0.80 | L3MBTL1 (0.57) | CYP2C19CYP2C9L3MBTL1EYA3MEN1 | |
| SCHEMBL11673639 | 0.80 | CYP2C19 (0.67) | CYP2C19CYP2C9L3MBTL1EYA3MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4024273-A | Coronary vasodilator and anti-anginal compositions comprising substituted benzofurans and benzothiophenes and methods of producing coronary vasodilation and anti-anginal activity | SMITHKLINE CORPORATION (US) | 1977-05-17 | — | — | US | disclosed |
| US-3947470-A | CORONARY VASODILATORS, TREATMENT OF ANGINA PECTORIS | SMITHKLINE CORPORATION (US) | 1976-03-30 | — | — | US | disclosed |