Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.35 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.35 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8477764 | 0.92 | MAPT (0.41) | MAPTEGFRMAPK1ALDH1A1CYP2D6 | |
| SCHEMBL8482399 | 0.91 | KDM4E (0.41) | MAPTMAPK1ALDH1A1CYP2D6L3MBTL1 | |
| SCHEMBL8478346 | 0.91 | KDM1A (0.41) | MAPTEGFRMAPK1ALDH1A1CYP2D6 | |
| SCHEMBL8478317 | 0.89 | ITGB3 (0.41) | MAPTEGFRALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL8482595 | 0.86 | S1PR1 (0.37) | MAPTEGFRALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL8479012 | 0.81 | ESRRG (0.39) | MAPTEGFRALDH1A1SMN1; SMN2 | |
| SCHEMBL8505444 | 0.80 | CHRM5 (0.30) | — | |
| SCHEMBL8478663 | 0.79 | EGFR (0.49) | MAPTEGFRALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL8477836 | 0.76 | — | — | |
| SCHEMBL14001890 | 0.75 | MAPT (0.59) | MAPTMAPK1ALDH1A1CYP2D6CYP2C9 |
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-5871709-A | TETRAAZACYCLODODECANE COMPOUNDS SUBSTITUTED WITH ALKYL CARBOXY COMPOUNDS FOR CARDIOVASCULAR DISORDERS AND BRAIN TUMORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-02-16 | — | — | US | disclosed |