Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.42 |
| ▸ | SYK | P43405 | 6/20 | 0.41 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 9/20 | 0.38 |
| ▸ | JAK1 | P23458 | 9/20 | 0.38 |
| ▸ | JAK3 | P52333 | 11/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18534995 | 1.00 | TAS1R3 (0.42) | TAS1R3TAS1R1SYKTAS1R2JAK2 | |
| SCHEMBL18534498 | 0.96 | SYK (0.42) | TAS1R3TAS1R1SYKJAK2JAK1 | |
| SCHEMBL18534969 | 0.91 | SYK (0.44) | SYKJAK2JAK1JAK3 | |
| SCHEMBL18534587 | 0.90 | TAS1R3 (0.40) | TAS1R3TAS1R1SYKTAS1R2JAK2 | |
| SCHEMBL18534622 | 0.90 | JAK3 (0.46) | SYKJAK2JAK1JAK3CYP2C9 | |
| SCHEMBL18534795 | 0.90 | JAK3 (0.46) | SYKJAK2JAK1JAK3CYP2C9 | |
| SCHEMBL18534999 | 0.90 | JAK3 (0.46) | SYKJAK2JAK1JAK3CYP2C9 | |
| SCHEMBL18534819 | 0.88 | SYK (0.46) | SYKJAK2JAK1JAK3 | |
| SCHEMBL18534487 | 0.88 | JAK3 (0.51) | SYKJAK2JAK1JAK3 | |
| SCHEMBL18534561 | 0.87 | SYK (0.52) | SYKJAK2JAK1JAK3CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2763990-B1 | PYRROLOPYRAZINE KINASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2017-02-22 | — | — | EP | disclosed |