Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 7/20 | 0.36 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 3/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | MCHR2 | Q969V1 | 2/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 2/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25910174 | 0.91 | ADORA2A (0.44) | ADORA2AADORA1MAP3K12BRAFACACB | |
| SCHEMBL25910282 | 0.84 | TLR7 (0.34) | ADORA2AADORA1MAP3K12ACACBMCHR2 | |
| SCHEMBL25911492 | 0.84 | TLR7 (0.34) | ADORA2AADORA1ACACBMCHR2MCHR1 | |
| SCHEMBL25911473 | 0.81 | CSF1R (0.48) | KDRFGFR1 | |
| SCHEMBL25909902 | 0.81 | CSF1R (0.48) | KDRFGFR1 | |
| SCHEMBL25912707 | 0.80 | P2RX3 (0.40) | P2RX3BRAFKDR | |
| SCHEMBL25910691 | 0.80 | CSF1R (0.38) | BRAFKDRFGFR1 | |
| SCHEMBL25911490 | 0.79 | KCNH2 (0.37) | ADORA2AADORA1MCHR1HRH3 | |
| SCHEMBL25913221 | 0.78 | P2RX3 (0.38) | P2RX3BRAFHRH3KDR | |
| SCHEMBL25910701 | 0.77 | SCN9A (0.38) | BRAFKDRFGFR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023125812-A1 | SUBSTITUTED PYRIMIDONE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF | 上海海雁医药科技有限公司 | 2023-07-06 | — | — | WO | disclosed |