Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNMT1 | P26358 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | WDR5 | P61964 | 1/20 | 0.36 |
| ▸ | TYMP | P19971 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | ADK | P55263 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL30436853 | 1.00 | DNMT1 (0.39) | DNMT1DHFRGPR84WDR5TYMP | |
| Hydrochloric Acid SCHEMBL8719043 | 0.98 | DNMT1 (0.38) | DNMT1DHFRGPR84WDR5TYMP | |
| SCHEMBL30616100 | 0.98 | DNMT1 (0.40) | DNMT1DHFRGPR84WDR5TYMP | |
| SCHEMBL275907 | 0.98 | DNMT1 (0.40) | DNMT1DHFRGPR84WDR5TYMP | |
| SCHEMBL29368065 | 0.98 | DNMT1 (0.40) | DNMT1DHFRGPR84WDR5TYMP | |
| Hydrochloric Acid SCHEMBL8719044 | 0.95 | DNMT1 (0.38) | DNMT1DHFRGPR84WDR5TYMP | |
| SCHEMBL5805612 | 0.94 | GPR84 (0.38) | DNMT1DHFRGPR84WDR5TYMP | |
| SCHEMBL29124520 | 0.92 | TYMP (0.36) | DNMT1DHFRGPR84WDR5TYMP | |
| SCHEMBL8418840 | 0.92 | WDR5 (0.37) | DNMT1DHFRGPR84WDR5TYMP | |
| SCHEMBL8719045 | 0.92 | TYMP (0.36) | DNMT1DHFRGPR84WDR5TYMP |
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 |
|---|---|---|---|---|---|---|---|
| CN-115820700-A | Recombinant expression vector containing RKRED nucleotide sequence, recombinant engineering bacteria, construction method, enzyme and application thereof | 浙江正硕生物科技有限公司 | 2023-03-21 | — | — | CN | disclosed |
| EP-0885210-A1 | Tricylic compounds having binding affinity for melatonin receptors, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997032871-A1 | TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-09-12 | — | — | WO | disclosed |