Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.38 |
| ▸ | PTGIR | P43119 | 4/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 2/20 | 0.35 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25338586 | 0.90 | ITGB3 (0.43) | S1PR5PTGIRDGAT1ITGB3ITGA2B | |
| SCHEMBL29132477 | 0.87 | S1PR5 (0.34) | S1PR5PTGIRPPARGPPARAHTR2C | |
| SCHEMBL29132508 | 0.79 | PTGIR (0.38) | PTGIRITGB3ITGA2BFFAR1HTR2C | |
| SCHEMBL30683967 | 0.79 | PTGIR (0.38) | PTGIRITGB3ITGA2BFFAR1HTR2C | |
| SCHEMBL25336821 | 0.78 | PTGIR (0.37) | S1PR5PTGIRITGB3ITGA2BHTR2C | |
| SCHEMBL25338513 | 0.77 | BRD4 (0.37) | S1PR5HTR2C | |
| SCHEMBL25339114 | 0.76 | ALDH1A1 (0.42) | DGAT1ITGB3ITGA2BFFAR1 | |
| SCHEMBL25339339 | 0.74 | MEN1 (0.35) | — | |
| SCHEMBL29626301 | 0.73 | ACACB (0.41) | — | |
| SCHEMBL22412174 | 0.73 | CA1 (0.44) | — |
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-116829555-A | Protein tyrosine phosphatase inhibitors and methods of use thereof | 卡里科生命科学有限责任公司 | 2023-09-29 | — | — | CN | disclosed |