Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | CES2 | O00748 | 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 | |
|---|---|---|---|---|
| SCHEMBL9616483 | 1.00 | CES1 (0.31) | CES1CA1ALDH1A1TSHRCES2 | |
| SCHEMBL9397218 | 0.88 | ALDH1A1 (0.32) | ALDH1A1TSHR | |
| SCHEMBL9397223 | 0.88 | ALDH1A1 (0.32) | ALDH1A1TSHR | |
| SCHEMBL9198478 | 0.79 | — | — | |
| SCHEMBL4104103 | 0.79 | — | — | |
| SCHEMBL4104107 | 0.79 | — | — | |
| SCHEMBL6570499 | 0.75 | — | — | |
| SCHEMBL11214991 | 0.75 | MEN1 (0.33) | ALDH1A1TSHR | |
| SCHEMBL6570497 | 0.75 | — | — | |
| SCHEMBL11214987 | 0.75 | MEN1 (0.33) | ALDH1A1TSHR |
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-0514192-A1 | Antihypertensive benzofuran derivatives, substituted by varied N-pyrimidinyl- or N-imidazolyl-methyl groups | GLAXO GROUP LIMITED (GB) | 1992-11-19 | — | — | EP | disclosed |