Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 10/20 | 0.51 |
| ▸ | CDC25B | P30305 | 1/20 | 0.49 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6680251 | 0.87 | HCAR3 (0.66) | HCAR3MAPTSMN1; SMN2ALDH1A1KMT2A | |
| Methyl Alcohol SCHEMBL28201843 | 0.82 | HCAR3 (0.73) | HCAR3CDC25BVCAM1MAPTALDH1A1 | |
| Methyl Alcohol SCHEMBL28201441 | 0.82 | HCAR3 (0.76) | HCAR3CDC25BVCAM1MAPTALDH1A1 | |
| Methyl Alcohol SCHEMBL28201372 | 0.78 | CDC25B (0.76) | HCAR3CDC25BVCAM1MAPTSMN1; SMN2 | |
| SCHEMBL28219732 | 0.78 | MAPT (0.50) | MAPTSMN1; SMN2ALDH1A1KMT2AMAPK1 | |
| SCHEMBL25373265 | 0.78 | HCAR3 (0.54) | HCAR3MAPTKMT2A | |
| SCHEMBL25373263 | 0.78 | HCAR3 (0.54) | HCAR3MAPTKMT2A | |
| SCHEMBL989785 | 0.78 | CES2 (0.58) | HCAR3CDC25BMAPTPKMKMT2A | |
| SCHEMBL30590597 | 0.77 | KMT2A (0.59) | HCAR3CDC25BVCAM1MAPTPKM | |
| SCHEMBL29117538 | 0.77 | KMT2A (0.59) | HCAR3CDC25BVCAM1MAPTPKM |
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 |