Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | LARS1 | Q9P2J5 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28295578 | 0.83 | LARS1 (0.42) | ALDH1A1HPGDMAPTL3MBTL1KDM4E | |
| SCHEMBL12180442 | 0.79 | ALDH1A1 (0.45) | ALDH1A1HPGDMAPTL3MBTL1KDM4E | |
| SCHEMBL23906325 | 0.78 | ALDH1A1 (0.42) | ALDH1A1HPGDMAPTL3MBTL1KDM4E | |
| SCHEMBL13888142 | 0.76 | ALDH1A1 (0.46) | ALDH1A1HPGDMAPTL3MBTL1KDM4E | |
| SCHEMBL2123778 | 0.76 | TUBB1 (0.40) | ALDH1A1HPGDMAPTL3MBTL1KDM4E | |
| SCHEMBL27902742 | 0.76 | ALDH1A1 (0.50) | ALDH1A1HPGDMAPTL3MBTL1KDM4E | |
| SCHEMBL27777942 | 0.74 | HPGD (0.39) | ALDH1A1HPGDMAPTL3MBTL1KDM4E | |
| SCHEMBL28254022 | 0.74 | ALDH1A1 (0.43) | ALDH1A1HPGDMAPTKDM4EMEN1 | |
| SCHEMBL27777943 | 0.74 | HPGD (0.39) | ALDH1A1HPGDMAPTL3MBTL1KDM4E | |
| SCHEMBL19121394 | 0.74 | ALDH1A1 (0.44) | ALDH1A1HPGDMAPTL3MBTL1KDM4E |
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-0793656-B1 | NOVEL BENZYL PYRIMIDINES | BASILEA PHARMACEUTICA AG (CH) | 2003-03-26 | — | — | EP | disclosed |
| EP-0793656-A1 | NOVEL BENZYL PYRIMIDINES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-09-10 | — | — | EP | disclosed |
| WO-1996016046-A2 | NOVEL BENZYL PYRIMIDINES | F. HOFFMANN-LA ROCHE AG (CH) | 1996-05-30 | — | — | WO | disclosed |