Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 2/20 | 0.49 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.41 |
| ▸ | MTOR | P42345 | 3/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.41 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL673209 | 0.83 | FFAR1 (0.59) | FFAR1PIK3CAMTORGRM5NPC1 | |
| SCHEMBL15688668 | 0.80 | ALDH1A1 (0.53) | FFAR1PIK3CAMTORNPC1KDM4E | |
| SCHEMBL28933420 | 0.76 | CA12 (0.57) | FFAR1GRM5NPC1KDM4EALDH1A1 | |
| SCHEMBL28933437 | 0.76 | FFAR1 (0.53) | FFAR1PIK3CAMTORGRM5NPC1 | |
| SCHEMBL28933373 | 0.76 | FFAR1 (0.53) | FFAR1NPC1KDM4EALDH1A1CYP3A4 | |
| SCHEMBL2925968 | 0.75 | APP (0.67) | FFAR1PIK3CAMTORPIK3CDPIK3CG | |
| SCHEMBL1820120 | 0.75 | HDAC8 (0.58) | FFAR1PIK3CAMTORPIK3CDPIK3CG | |
| Acetic Acid SCHEMBL28454105 | 0.74 | FFAR1 (0.59) | FFAR1MTORNPC1KDM4EALDH1A1 | |
| SCHEMBL17224548 | 0.73 | APP (0.63) | FFAR1PIK3CAMTORPIK3CDPIK3CG | |
| Methyl Alcohol SCHEMBL28280712 | 0.73 | GRM5 (0.52) | FFAR1PIK3CAMTORPIK3CDPIK3CG |
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-117024759-A | Organic Pt metal macrocyclic group two-dimensional supermolecule assembly constructed based on oriented cation-pi action, and preparation method and application thereof | 陕西中医药大学 | 2023-11-10 | — | — | CN | disclosed |