Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL286492 | 0.87 | DAGLA (0.43) | DAGLANPSR1MAPK1MAPTCYP1A2 | |
| SCHEMBL161081 | 0.76 | DAGLA (0.43) | DAGLANPSR1MAPK1MAPTCYP1A2 | |
| SCHEMBL4484701 | 0.74 | DAGLA (0.42) | DAGLANPSR1MAPK1MAPTCYP1A2 | |
| SCHEMBL1027752 | 0.74 | DAGLA (0.42) | DAGLANPSR1MAPK1MAPTCYP1A2 | |
| SCHEMBL11921730 | 0.74 | NPSR1 (0.40) | NPSR1MAPK1MAPTCYP1A2TP53 | |
| SCHEMBL25234479 | 0.74 | DAGLA (0.42) | DAGLANPSR1MAPK1MAPTCYP1A2 | |
| SCHEMBL1196102 | 0.74 | DAGLA (0.42) | DAGLANPSR1MAPK1MAPTCYP1A2 | |
| SCHEMBL7324378 | 0.71 | DAGLA (0.40) | DAGLANPSR1MAPK1MAPTTP53 | |
| SCHEMBL16130104 | 0.71 | DAGLA (0.43) | DAGLANPSR1MAPK1 | |
| SCHEMBL77505 | 0.71 | DAGLA (0.40) | DAGLANPSR1MAPK1MAPTTP53 |
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-115667273-A | Competitive and non-competitive inhibitors of muscarinic acetylcholine receptor M5 | 范德堡大学 | 2023-01-31 | — | — | CN | disclosed |