Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MGAM | O43451 | 2/20 | 0.43 |
| ▸ | SI | P14410 | 2/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | ALPL | P05186 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | ALPI | P09923 | 1/20 | 0.43 |
| ▸ | ALPG | P10696 | 1/20 | 0.43 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.43 |
| ▸ | SLC27A2 | O14975 | 1/20 | 0.36 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.36 |
| ▸ | TGM2 | P21980 | 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 | |
|---|---|---|---|---|
| SCHEMBL29716665 | 0.96 | PDK2 (0.47) | MAPTKDM4EALDH1A1PDK2LMNA | |
| SCHEMBL30618486 | 0.90 | PDK2 (0.41) | MAPTKDM4EALDH1A1PDK2LMNA | |
| SCHEMBL31072313 | 0.89 | PDK2 (0.47) | MAPTKDM4EALDH1A1PDK2LMNA | |
| SCHEMBL29651975 | 0.86 | PDK2 (0.44) | MAPTKDM4EALDH1A1PDK2LMNA | |
| SCHEMBL18314522 | 0.83 | LMNA (0.47) | MAPTKDM4EALDH1A1PDK2LMNA | |
| SCHEMBL29416297 | 0.83 | LMNA (0.47) | MAPTKDM4EALDH1A1PDK2LMNA | |
| SCHEMBL30019109 | 0.82 | LMNA (0.40) | MAPTKDM4EALDH1A1PDK2LMNA | |
| SCHEMBL783450 | 0.81 | PDK2 (0.58) | MAPTKDM4EALDH1A1PDK2LMNA | |
| SCHEMBL996751 | 0.81 | PDK2 (0.58) | MAPTKDM4EALDH1A1PDK2LMNA | |
| SCHEMBL783463 | 0.81 | PDK2 (0.58) | MAPTKDM4EALDH1A1PDK2LMNA |
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-118373847-A | Spiro self-assembled single-molecule hole transport material and preparation method and application thereof | 华北电力大学 | 2024-07-23 | — | — | CN | claimed |
| CN-118373847-A | Spiro self-assembled single-molecule hole transport material and preparation method and application thereof | 华北电力大学 | 2024-07-23 | — | — | CN | disclosed |