Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17186655 | 0.89 | TSHR (0.58) | TSHRHSD17B10 | |
| SCHEMBL11569672 | 0.86 | TSHR (0.56) | TSHRHSD17B10 | |
| SCHEMBL11572476 | 0.86 | TSHR (0.56) | TSHRHSD17B10 | |
| SCHEMBL26205671 | 0.86 | TSHR (0.56) | TSHRHSD17B10 | |
| SCHEMBL11571608 | 0.86 | TSHR (0.56) | TSHRHSD17B10 | |
| SCHEMBL9585705 | 0.86 | CYP1A2 (0.39) | TSHRCYP1A2CYP2D6MAPTCYP2C9 | |
| SCHEMBL766061 | 0.86 | TSHR (0.56) | TSHRHSD17B10 | |
| SCHEMBL11572511 | 0.86 | TSHR (0.56) | TSHRHSD17B10 | |
| SCHEMBL26205674 | 0.86 | TSHR (0.56) | TSHRHSD17B10 | |
| SCHEMBL26205673 | 0.86 | TSHR (0.56) | TSHRHSD17B10 |
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-0543919-B1 | USE OF HETEROCYCLIC AMINO-ALCOHOL COMPOUNDS IN THE MANUFACTURE OF A MEDICAMENT FOR TREATMENT OF CNS DISEASES | SEARLE & CO (US) | 1996-04-10 | — | — | EP | claimed |