Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | OXTR | P30559 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.33 |
| ▸ | GABRE | P78334 | 1/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.33 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.33 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.33 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11899775 | 0.84 | GCG (0.34) | GABRB3GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29620920 | 0.78 | HDAC4 (0.49) | PTGS1ALDH1A1KDM4ESMN1; SMN2KMT2A | |
| SCHEMBL22925947 | 0.78 | HDAC4 (0.49) | PTGS1ALDH1A1KDM4ESMN1; SMN2KMT2A | |
| SCHEMBL12818406 | 0.75 | NOTUM (0.44) | EPHX2XDHKIF11 | |
| SCHEMBL17076806 | 0.75 | HSP90AA1 (0.35) | ALDH1A1NOS3NOS2 | |
| SCHEMBL18394251 | 0.74 | SMN1; SMN2 (0.49) | GABRB3ALDH1A1KDM4EPOLBSMN1; SMN2 | |
| SCHEMBL11900267 | 0.73 | MAOB (0.37) | GABRB3GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL11900236 | 0.73 | EPHX2 (0.44) | GABRB3GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL20028199 | 0.72 | EPHX2 (0.39) | GABRB3GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL16566374 | 0.71 | ALDH1A1 (0.33) | ALDH1A1KDM4E |
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-117430589-A | 2-aminopyrimidine compound or salt thereof, and preparation method and application thereof | 励缔(杭州)医药科技有限公司 | 2024-01-23 | — | — | CN | disclosed |