Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 9/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL28309415 | 0.80 | ESR1 (0.55) | ESR1ESR2SLC6A3SLC6A4HSD11B1 | |
| SCHEMBL18440458 | 0.77 | TSHR (0.58) | TSHRHTTEPHX2HSD17B10SLC6A3 | |
| SCHEMBL12002346 | 0.77 | ESR1 (0.52) | ESR1ESR2SLC6A3SLC6A4HSD11B1 | |
| SCHEMBL8735345 | 0.76 | ESR1 (0.59) | ESR1ESR2SLC6A3SLC6A4HSD11B1 | |
| SCHEMBL5682331 | 0.75 | CNR2 (0.52) | ESR1ESR2SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL8706024 | 0.74 | ESR2 (0.57) | ESR1ESR2SLC6A3SLC6A4HSD11B1 | |
| SCHEMBL12000487 | 0.73 | ESR1 (0.47) | ESR1ESR2SLC6A3SLC6A4HSD11B1 | |
| SCHEMBL4564526 | 0.73 | CNR2 (0.58) | ESR1ESR2HSD17B10SLC6A3SLC6A4 | |
| SCHEMBL10791207 | 0.73 | ESR1 (0.55) | ESR1ESR2SLC6A3SLC6A4SLC6A2 | |
| SCHEMBL5678460 | 0.72 | CNR2 (0.60) | ESR1ESR2HSD17B10SLC6A3SLC6A4 |
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-3041841-B1 | TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF | HOFFMANN LA ROCHE (CH) | 2019-06-05 | — | — | EP | disclosed |