Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.88 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.88 |
| ▸ | MAPT | P10636 | 2/20 | 0.68 |
| ▸ | MAOB | P27338 | 12/20 | 0.54 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL30132496 | 0.94 | ALDH1A1 (1.00) | ALDH1A1KDM4EMAPTMAOBHTR2C | |
| SCHEMBL1983108 | 0.94 | ALDH1A1 (1.00) | ALDH1A1KDM4EMAPTMAOBHTR2C | |
| SCHEMBL12478774 | 0.87 | ALDH1A1 (0.72) | ALDH1A1KDM4EMAPTMAOBNPC1 | |
| SCHEMBL1146916 | 0.81 | MAPT (1.00) | ALDH1A1KDM4EMAPTMAOBNPC1 | |
| SCHEMBL27766391 | 0.77 | KDM4E (0.65) | ALDH1A1KDM4EMAPTMAOBHTR2C | |
| SCHEMBL11369382 | 0.77 | KDM4E (0.68) | ALDH1A1KDM4EMAPTMAOBHTR2C | |
| SCHEMBL6385719 | 0.76 | ALDH1A1 (0.69) | ALDH1A1KDM4EMAPTMAOBNPC1 | |
| SCHEMBL4728857 | 0.76 | KDM4E (0.69) | ALDH1A1KDM4EMAPTMAOBHTR2C | |
| SCHEMBL12478153 | 0.76 | ALDH1A1 (0.63) | ALDH1A1KDM4EMAPTMAOBNPC1 | |
| SCHEMBL6552997 | 0.75 | ALDH1A1 (0.67) | ALDH1A1KDM4EMAPTMAOBHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-1156801-A4 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORP (US) | 2003-05-14 | — | — | EP | disclosed |
| EP-1156801-A1 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-11-28 | — | — | EP | disclosed |
| WO-2000053175-A1 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-09-14 | — | — | WO | disclosed |