Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.59 |
| ▸ | RELA | Q04206 | 1/20 | 0.59 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | CETP | P11597 | 2/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.48 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28674605 | 0.81 | FFAR1 (0.51) | RAB9ANPC1ALDH1A1ALOX15MAPT | |
| SCHEMBL30343191 | 0.81 | CETP (0.44) | RAB9ANPC1ALDH1A1ALOX15MAPT | |
| SCHEMBL14355939 | 0.79 | MAPT (0.44) | RAB9ANPC1ALDH1A1ALOX15MAPT | |
| SCHEMBL28346162 | 0.74 | CETP (0.54) | RAB9ANPC1ALDH1A1ALOX15MAPT | |
| SCHEMBL27521404 | 0.72 | HCAR2 (0.68) | — | |
| SCHEMBL11218848 | 0.71 | ALDH1A1 (0.63) | RAB9ANPC1ALDH1A1MAPTMAPK1 | |
| SCHEMBL14387674 | 0.69 | ALDH1A1 (0.46) | RAB9ANPC1ALDH1A1ALOX15MAPT | |
| SCHEMBL13212279 | 0.69 | CETP (1.00) | ALDH1A1MAPK1CETPHDAC3HDAC2 | |
| SCHEMBL5144265 | 0.68 | HDAC3 (0.53) | RAB9ANPC1ALDH1A1ALOX15MAPT | |
| SCHEMBL28693497 | 0.68 | CETP (0.48) | ALDH1A1MAPTSMN1; SMN2CETPHDAC3 |
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-113861086-B | Synthesis method of sulfur-containing gamma, gamma-diarylamine butyrylamide compound | 温州大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-113861086-A | Synthesis method of sulfur-containing gamma, gamma-diarylamine butyrylamide compound | 温州大学 | 2021-12-31 | — | — | CN | disclosed |