Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | DAO | P14920 | 3/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.38 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL14483 | 0.84 | TAAR1 (0.59) | TAAR1HRH3IDO1DAOGPR84 | |
| SCHEMBL21868801 | 0.83 | TAAR1 (0.62) | TAAR1HRH3IDO1DAOACHE | |
| SCHEMBL3631399 | 0.82 | TAAR1 (0.52) | TAAR1HRH3IDO1DAOGPR84 | |
| SCHEMBL14542694 | 0.81 | TAAR1 (0.50) | TAAR1IDO1 | |
| SCHEMBL24288749 | 0.79 | TAAR1 (0.56) | TAAR1HRH3IDO1DAOACHE | |
| SCHEMBL12062430 | 0.78 | ACHE (0.41) | TAAR1ACHE | |
| SCHEMBL3056983 | 0.77 | TAAR1 (0.59) | TAAR1HRH3IDO1DAOACHE | |
| SCHEMBL29596752 | 0.76 | TAAR1 (0.74) | TAAR1HRH3IDO1DAOACHE | |
| SCHEMBL8096473 | 0.76 | TAAR1 (0.74) | TAAR1HRH3IDO1DAOACHE | |
| SCHEMBL18773960 | 0.76 | TAAR1 (0.41) | TAAR1HRH3IDO1DAOGPR84 |
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-2018098208-A1 | NITROGEN RING LINKED DEOXYURIDINE TRIPHOSPHATASE INHIBITORS | CV6 THERAPEUTICS (NI) LIMITED (GB) | 2018-05-31 | — | — | WO | disclosed |