Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 3/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.36 |
| ▸ | ITGAV | P06756 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.36 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.36 |
| ▸ | ITGAL | P20701 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 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 | |
|---|---|---|---|---|
| SCHEMBL30343190 | 0.89 | CETP (0.45) | CETPEPHX2HDAC3HDAC1RAB9A | |
| SCHEMBL30343196 | 0.89 | MAPT (0.48) | CETPEPHX2HDAC3HDAC1RAB9A | |
| SCHEMBL30343194 | 0.85 | KMT2A (0.42) | CETPEPHX2HDAC3HDAC1RAB9A | |
| SCHEMBL30343191 | 0.83 | CETP (0.44) | CETPEPHX2HDAC3HDAC1RAB9A | |
| SCHEMBL28346162 | 0.72 | CETP (0.54) | CETPHDAC3HDAC1RAB9AL3MBTL1 | |
| SCHEMBL19601473 | 0.70 | ADRA2A (0.43) | CETPHDAC3HDAC1L3MBTL1ALDH1A1 | |
| SCHEMBL11218848 | 0.70 | ALDH1A1 (0.63) | CETPHDAC3HDAC1RAB9AL3MBTL1 | |
| SCHEMBL30513841 | 0.68 | HDAC3 (0.46) | CETPHDAC3HDAC1L3MBTL1ITGB2 | |
| SCHEMBL28674605 | 0.68 | FFAR1 (0.51) | CETPHDAC3HDAC1RAB9AALDH1A1 | |
| SCHEMBL28277559 | 0.67 | MAPT (0.62) | HDAC3HDAC1RAB9AL3MBTL1ALDH1A1 |
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-113861086-B | Synthesis method of sulfur-containing gamma, gamma-diarylamine butyrylamide compound | 温州大学 | 2023-04-07 | — | — | CN | disclosed |