Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 11/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA7 | P43166 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19030530 | 0.89 | GPR119 (0.43) | GPR119ALDH1A1LMNAMAPTHRH3 | |
| SCHEMBL19030303 | 0.85 | MAPT (0.46) | GPR119ALDH1A1LMNAMAPTHRH3 | |
| SCHEMBL23110693 | 0.82 | ALPL (0.34) | ALDH1A1LMNAMAPTCA1CA2 | |
| SCHEMBL23110491 | 0.82 | GPR119 (0.49) | GPR119ALDH1A1LMNAMAPTHRH3 | |
| SCHEMBL23110805 | 0.79 | GPR119 (0.48) | GPR119HRH3ESR2KMT2A | |
| SCHEMBL3864362 | 0.79 | GPR119 (0.53) | GPR119HRH3KMT2A | |
| SCHEMBL25343723 | 0.79 | GPR119 (0.49) | GPR119ALDH1A1HRH3KMT2A | |
| SCHEMBL24408874 | 0.77 | GPR119 (0.46) | GPR119HRH3KMT2A | |
| SCHEMBL31024670 | 0.76 | GPR119 (0.46) | GPR119ALDH1A1HRH3KMT2A | |
| SCHEMBL20594509 | 0.76 | MAPT (0.52) | ALDH1A1LMNAMAPTKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112480101-B | IRAK4 kinase inhibitor, preparation and application thereof | 中国科学院上海药物研究所 | 2022-11-25 | — | — | CN | disclosed |
| WO-2021047677-A1 | IRAK4 KINASE INHIBITOR AND PREPARATION THEREOF AND USE THEREOF | 中国科学院上海药物研究所 | 2021-03-18 | — | — | WO | disclosed |