Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 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 | |
|---|---|---|---|---|
| SCHEMBL30106799 | 1.00 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL28513242 | 1.00 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL29231801 | 0.87 | L3MBTL1 (0.52) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL30106780 | 0.87 | L3MBTL1 (0.52) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL23030074 | 0.85 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL29231836 | 0.85 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL21515184 | 0.84 | L3MBTL1 (0.51) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL28516894 | 0.84 | L3MBTL1 (0.51) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL30387286 | 0.84 | L3MBTL1 (0.51) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL23005261 | 0.80 | FPR2 (0.51) | ALDH1A1KDM4EHPGDMAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-112218858-A | 2, 6-diamino-3, 4-dihydropyrimidin-4-one derivatives and their use in therapy | 托马斯·黑勒戴药物研究基金会 | 2021-01-12 | — | — | CN | disclosed |