Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 18/20 | 0.62 |
| ▸ | TACR2 | P21452 | 12/20 | 0.62 |
| ▸ | TACR3 | P29371 | 9/20 | 0.57 |
| ▸ | TAC3 | Q9UHF0 | 1/20 | 0.43 |
| ▸ | STS | P08842 | 1/20 | 0.42 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1971139 | 1.00 | TACR1 (0.62) | TACR1TACR2TACR3TAC3STS | |
| SCHEMBL30693212 | 0.95 | TACR1 (0.64) | TACR1TACR2TACR3TAC3RORC | |
| SCHEMBL1969074 | 0.95 | TACR1 (0.64) | TACR1TACR2TACR3TAC3RORC | |
| SCHEMBL1971701 | 0.93 | TACR1 (0.72) | TACR1TACR2TACR3 | |
| SCHEMBL1972383 | 0.93 | TACR1 (0.72) | TACR1TACR2TACR3 | |
| SCHEMBL30693140 | 0.93 | TACR1 (0.72) | TACR1TACR2TACR3 | |
| SCHEMBL30693207 | 0.92 | TACR1 (0.61) | TACR1TACR2TACR3TAC3 | |
| SCHEMBL1971047 | 0.92 | TACR1 (0.61) | TACR1TACR2TACR3TAC3 | |
| SCHEMBL1974018 | 0.92 | TACR1 (0.61) | TACR1TACR2TACR3RORC | |
| SCHEMBL1974090 | 0.89 | TACR1 (0.64) | TACR1TACR2TACR3TAC3 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE49686-E1 | Nitrogen-containing heterocyclic compound and use of same | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2023-10-10 | — | — | US | disclosed |