Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | DPP4 | P27487 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | LOX | P28300 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28426712 | 0.89 | ALDH1A1 (0.51) | PDK2ALDH1A1NPC1L3MBTL1KMT2A | |
| SCHEMBL28424892 | 0.85 | ALDH1A1 (0.47) | PDK2ALDH1A1NPC1L3MBTL1KMT2A | |
| SCHEMBL27995348 | 0.77 | ALDH1A1 (0.60) | ALDH1A1L3MBTL1KMT2ANPSR1 | |
| SCHEMBL10721062 | 0.76 | KMT2A (0.60) | PDK2ALDH1A1NPC1L3MBTL1KMT2A | |
| SCHEMBL28972225 | 0.75 | ALDH1A1 (0.62) | ALDH1A1L3MBTL1NPSR1 | |
| SCHEMBL18767537 | 0.74 | ALDH1A1 (0.57) | PDK2ALDH1A1DPP4NPC1L3MBTL1 | |
| SCHEMBL6172949 | 0.74 | NPC1 (0.53) | PDK2ALDH1A1NPC1L3MBTL1KMT2A | |
| SCHEMBL28514213 | 0.74 | ALDH1A1 (0.55) | PDK2ALDH1A1NPC1L3MBTL1KMT2A | |
| SCHEMBL24435015 | 0.73 | KMT2A (0.59) | PDK2ALDH1A1NPC1KMT2ALOX | |
| SCHEMBL1762519 | 0.73 | KMT2A (0.59) | PDK2ALDH1A1NPC1KMT2ALOX |
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-111410812-B | Preparation method of spiral polyphenylacetylene/silicon-based hybrid porous material | 哈尔滨工程大学 | 2023-03-21 | — | — | CN | disclosed |