Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5094882 | 0.77 | MEN1 (0.45) | MEN1KMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL29098855 | 0.77 | ALDH1A1 (0.46) | MEN1KMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL13113542 | 0.77 | MEN1 (0.66) | MEN1KMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL28124144 | 0.77 | MEN1 (0.45) | MEN1KMT2AALDH1A1HPGDKDM4E | |
| Thioxanthene SCHEMBL29398766 | 0.76 | ALDH1A1 (0.61) | MEN1KMT2AALDH1A1HPGDKDM4E | |
| Thioxanthene SCHEMBL8717 | 0.76 | ALDH1A1 (0.61) | MEN1KMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL5536787 | 0.76 | ACHE (0.34) | MEN1KMT2A | |
| Fluoride SCHEMBL28542369 | 0.76 | ALDH1A1 (0.44) | MEN1KMT2AALDH1A1HPGDKDM4E | |
| SCHEMBL28247140 | 0.74 | MEN1 (0.50) | MEN1KMT2AALDH1A1HPGDKDM4E | |
| Thioxanthene SCHEMBL31106427 | 0.74 | ALDH1A1 (0.59) | MEN1KMT2AALDH1A1HPGDKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997006178-A1 | PYRIMIDINE NUCLEOSIDES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-02-20 | — | — | WO | disclosed |