Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.35 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5165989 | 1.00 | CA1 (0.50) | CA1CA2CA4TRPA1TRPM8 | |
| SCHEMBL12572512 | 0.85 | TRPA1 (0.38) | CA1CA2CA4TRPA1TRPM8 | |
| SCHEMBL10297575 | 0.85 | CA1 (0.39) | CA1CA2CA4TRPA1TRPM8 | |
| SCHEMBL3480047 | 0.84 | CA1 (0.48) | CA1CA2CA4TRPA1TRPM8 | |
| SCHEMBL12166791 | 0.79 | CA1 (0.43) | CA1CA2CA4 | |
| SCHEMBL3480157 | 0.76 | CA1 (0.44) | CA1CA2CA4 | |
| SCHEMBL16202654 | 0.74 | MEN1 (0.35) | CA1CA2CA4TRPA1TRPM8 | |
| SCHEMBL15686712 | 0.74 | MEN1 (0.35) | CA1CA2CA4TRPA1TRPM8 | |
| SCHEMBL10289879 | 0.73 | — | — | |
| SCHEMBL622091 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9533986-B2 | Bicyclic dihydropyridone kinase inhibitors | PORTOLA PHARMACEUTICALS, INC. (US) | 2017-01-03 | — | — | US | disclosed |
| US-9040530-B2 | 1,2,4-triazine-6-carboxamide kinase inhibitors | PORTOLA PHARMACEUTICALS, INC. (US) | 2015-05-26 | — | — | US | disclosed |