Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 2/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.51 |
| ▸ | MEN1 | O00255 | 6/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 3/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | HPGD | P15428 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.42 |
| ▸ | CASP1 | P29466 | 2/20 | 0.42 |
| ▸ | CASP7 | P55210 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7147842 | 1.00 | ADORA2B (0.57) | ADORA2BL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL7145363 | 0.87 | TSHR (0.45) | ADORA2BL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL23204450 | 0.86 | ADORA2B (0.57) | ADORA2BL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL7151608 | 0.86 | ADORA2B (0.44) | ADORA2BL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL29623513 | 0.86 | ADORA2B (0.57) | ADORA2BL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL23162622 | 0.84 | ADORA2B (0.54) | ADORA2BL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL7146178 | 0.83 | ADORA2A (0.45) | ADORA2BL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL23162642 | 0.81 | ADORA2B (0.59) | ADORA2BL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL29623266 | 0.81 | ADORA2B (0.59) | ADORA2BL3MBTL1ALDH1A1MEN1KMT2A | |
| SCHEMBL23162858 | 0.79 | ADORA2B (0.50) | ADORA2BL3MBTL1ALDH1A1MEN1KMT2A |
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-114450277-A | Substituted pyrimidines for the treatment and prevention of hepatitis B virus infection | 豪夫迈·罗氏有限公司 | 2022-05-06 | — | — | CN | disclosed |