Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.65 |
| ▸ | IRAK4 | Q9NWZ3 | 4/20 | 0.51 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.43 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.43 |
| ▸ | PRKCI | P41743 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29116287 | 0.93 | MAPT (0.61) | MAPTIRAK4CHRM4CYP3A4NPC1 | |
| SCHEMBL6640948 | 0.83 | MAPT (0.60) | MAPTNPC1PKMLPAR2LPAR1 | |
| SCHEMBL2312296 | 0.80 | MAPT (0.48) | MAPTIRAK4CHRM4CYP3A4CYP2C9 | |
| SCHEMBL19933208 | 0.78 | NPC1 (0.47) | MAPTNPC1PKMLPAR2LPAR1 | |
| SCHEMBL30808040 | 0.78 | NPC1 (0.47) | MAPTNPC1PKMLPAR2LPAR1 | |
| SCHEMBL2312187 | 0.78 | MAPT (0.44) | MAPTIRAK4CHRM4CYP3A4CYP2C9 | |
| SCHEMBL14728009 | 0.78 | MAPT (0.46) | MAPTIRAK4CHRM4CYP3A4CYP2C9 | |
| SCHEMBL6644763 | 0.77 | NPC1 (0.46) | MAPTNPC1PKMLPAR2LPAR1 | |
| SCHEMBL7678911 | 0.76 | PRKCI (0.48) | MAPTIRAK4CHRM4CYP3A4CYP2C9 | |
| SCHEMBL19073108 | 0.76 | MAPT (0.46) | MAPTIRAK4CHRM4CYP3A4ALDH1A1 |
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-117126176-A | Thienopyrimidine compound and dopamine D thereof 2 Use of receptor allosteric antagonists | 常州大学 | 2023-11-28 | — | — | CN | disclosed |