Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.67 |
| ▸ | POLB | P06746 | 2/20 | 0.67 |
| ▸ | PKM | P14618 | 1/20 | 0.67 |
| ▸ | HPGD | P15428 | 4/20 | 0.65 |
| ▸ | TP53 | P04637 | 3/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.65 |
| ▸ | MEN1 | O00255 | 3/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | DAO | P14920 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 5/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL12883525 | 1.00 | ALDH1A1 (0.67) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL7218427 | 0.98 | ALDH1A1 (0.69) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL15407033 | 0.95 | DAO (0.69) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL28870926 | 0.82 | ALDH1A1 (0.96) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL28870929 | 0.82 | ALDH1A1 (0.96) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL3743711 | 0.82 | ALDH1A1 (0.96) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL13908042 | 0.81 | ALDH1A1 (0.68) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL20329146 | 0.81 | KDM4E (0.62) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL3304064 | 0.81 | PNMT (0.55) | ALDH1A1POLBPKMHPGDTP53 | |
| SCHEMBL3309479 | 0.81 | KDM4E (0.54) | ALDH1A1POLBPKMHPGDTP53 |
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-114929681-B | Bicyclic CX3CR1 receptor agonists | 德州大学系统董事会 | 2024-05-14 | — | — | CN | disclosed |
| CN-114929681-A | Bicyclic CX3CR1 receptor agonists | 德州大学系统董事会 | 2022-08-19 | — | — | CN | disclosed |