Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.39 |
| ▸ | FLT3 | P36888 | 2/20 | 0.39 |
| ▸ | KIT | P10721 | 1/20 | 0.39 |
| ▸ | WNT1 | P04628 | 3/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 5/20 | 0.38 |
| ▸ | BCR | P11274 | 5/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PRKACA | P17612 | 2/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.37 |
| ▸ | PLK4 | O00444 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29968009 | 0.92 | EPHX2 (0.42) | DYRK1AROCK2ROCK1FLT3KIT | |
| SCHEMBL29967968 | 0.87 | MAPK10 (0.44) | DYRK1AROCK2ROCK1FLT3KIT | |
| SCHEMBL29967878 | 0.84 | MAPK10 (0.45) | DYRK1AROCK2ROCK1FLT3KIT | |
| SCHEMBL28871262 | 0.84 | MAPK10 (0.45) | DYRK1AROCK2ROCK1FLT3KIT | |
| SCHEMBL29967890 | 0.81 | ACMSD (0.42) | DYRK1AROCK2ROCK1FLT3KIT | |
| SCHEMBL29967707 | 0.78 | MAPK10 (0.43) | DYRK1AROCK2ROCK1FLT3KIT | |
| SCHEMBL29967744 | 0.78 | EGFR (0.46) | DYRK1AROCK2ROCK1FLT3KIT | |
| SCHEMBL31029238 | 0.76 | KDR (0.41) | DYRK1AROCK2ROCK1FLT3KIT | |
| SCHEMBL29968386 | 0.76 | KDM4E (0.44) | DYRK1AROCK2ROCK1FLT3KIT | |
| Methyl Benzoate SCHEMBL31029245 | 0.74 | FLT3 (0.43) | DYRK1AROCK2ROCK1FLT3KIT |
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-115260165-A | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2022-11-01 | — | — | CN | disclosed |