Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 10/20 | 0.73 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.57 |
| ▸ | CDC25B | P30305 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL11238552 | 0.86 | HCAR3 (0.77) | HCAR3VCAM1CDC25BMAPTALDH1A1 | |
| Methyl Alcohol SCHEMBL28201372 | 0.85 | CDC25B (0.76) | HCAR3VCAM1CDC25BMAPTALDH1A1 | |
| SCHEMBL24032 | 0.85 | HCAR3 (1.00) | HCAR3MAPTALDH1A1HTTL3MBTL1 | |
| SCHEMBL29117538 | 0.84 | KMT2A (0.59) | HCAR3VCAM1CDC25BMAPTL3MBTL1 | |
| SCHEMBL30590597 | 0.84 | KMT2A (0.59) | HCAR3VCAM1CDC25BMAPTL3MBTL1 | |
| Methyl Alcohol SCHEMBL28201371 | 0.84 | ALDH1A1 (0.59) | HCAR3VCAM1CDC25BMAPTALDH1A1 | |
| Methyl Alcohol SCHEMBL28201441 | 0.84 | HCAR3 (0.76) | HCAR3VCAM1CDC25BMAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL1602524 | 0.83 | HCAR3 (0.97) | HCAR3MAPTALDH1A1HTTL3MBTL1 | |
| SCHEMBL11269607 | 0.83 | CDC25B (0.78) | HCAR3VCAM1CDC25BMAPTALDH1A1 | |
| SCHEMBL11544539 | 0.83 | KMT2A (0.58) | HCAR3VCAM1CDC25BMAPTALDH1A1 |
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-107635989-A | Benzimidizole derivatives as bromine domain inhibitor | 葛兰素史克知识产权开发有限公司 | 2018-01-26 | — | — | CN | disclosed |