Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.35 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.35 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 2/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.34 |
| ▸ | BRD4 | O60885 | 3/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | SMO | Q99835 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5098088 | 0.81 | MAPK1 (0.39) | MAPK1MAPK3TAOK1PRKD2PDE4A | |
| SCHEMBL31749574 | 0.71 | PTPN11 (0.34) | PDE4APDE4BPDE4CPDE4DL3MBTL1 | |
| SCHEMBL5091457 | 0.70 | MAPK1 (0.38) | MAPK1MAPK3TAOK1PRKD2ALDH1A1 | |
| SCHEMBL31167640 | 0.65 | MAPK1 (0.42) | MAPK1MAPK3TAOK1PRKD2CCNT1 | |
| SCHEMBL30599063 | 0.63 | MAPK1 (0.44) | MAPK1MAPK3TAOK1PRKD2CCNT1 | |
| SCHEMBL30599064 | 0.63 | MAPK1 (0.44) | MAPK1MAPK3TAOK1PRKD2CCNT1 | |
| SCHEMBL31318121 | 0.63 | MAPK1 (0.47) | MAPK1MAPK3TAOK1PRKD2CCNT1 | |
| SCHEMBL17958980 | 0.63 | MAPK1 (0.47) | MAPK1MAPK3TAOK1PRKD2CCNT1 | |
| SCHEMBL16932967 | 0.63 | L3MBTL1 (0.52) | BRD4ALDH1A1L3MBTL1PKMPOLB | |
| SCHEMBL16932968 | 0.63 | L3MBTL1 (0.41) | BRD4ALDH1A1L3MBTL1MEN1KMT2A |
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-118765276-A | Deuterated compound, preparation method and application thereof | 甘李药业股份有限公司 | 2024-10-11 | — | — | CN | disclosed |