Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | STS | P08842 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 4/20 | 0.42 |
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | CA9 | Q16790 | 4/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1713848 | 0.83 | MAPK1 (0.57) | MAPK1KDM4EL3MBTL1MAPTSTS | |
| SCHEMBL31434911 | 0.81 | MAPK1 (0.49) | MAPK1KDM4EL3MBTL1MAPTHPGD | |
| SCHEMBL840039 | 0.81 | MAPK1 (0.49) | MAPK1KDM4EL3MBTL1MAPTHPGD | |
| SCHEMBL1021132 | 0.81 | MAPK1 (0.59) | MAPK1KDM4EL3MBTL1MAPTSTS | |
| SCHEMBL25216018 | 0.78 | MAPK1 (0.56) | MAPK1KDM4EL3MBTL1MAPTSTS | |
| SCHEMBL14730772 | 0.78 | MAPK1 (0.57) | MAPK1KDM4EL3MBTL1MAPTSTS | |
| SCHEMBL25256850 | 0.75 | MAPK1 (0.53) | MAPK1KDM4EL3MBTL1MAPTSTS | |
| SCHEMBL880698 | 0.74 | MAPK1 (0.59) | MAPK1KDM4EL3MBTL1LOXL2MAPT | |
| SCHEMBL25256980 | 0.73 | MAPK1 (0.47) | MAPK1KDM4EL3MBTL1MAPTCA12 | |
| Hydrochloric Acid SCHEMBL366796 | 0.73 | MAPK1 (0.57) | MAPK1KDM4EL3MBTL1LOXL2MAPT |
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-116514790-A | Tri-aromatic heterocyclic piperazine small molecular organic compound targeting STAT3 and application thereof | 华东师范大学 | 2023-08-01 | — | — | CN | disclosed |