Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | DEGS1 | O15121 | 4/20 | 0.36 |
| ▸ | ACACB | O00763 | 3/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11103035 | 0.92 | ESR1 (0.48) | ESR1ESR2SLC6A4DEGS1ACACB | |
| Prisotinol SCHEMBL1229234 | 0.78 | ESR1 (0.58) | ESR1ESR2SLC6A4DEGS1HCAR2 | |
| Hydrochloric Acid SCHEMBL11099544 | 0.78 | ESR1 (0.58) | ESR1ESR2SLC6A4DEGS1 | |
| Prisotinol SCHEMBL9626289 | 0.76 | ESR1 (0.57) | ESR1ESR2SLC6A4DEGS1HCAR2 | |
| SCHEMBL11128368 | 0.76 | ESR1 (0.57) | ESR1ESR2SLC6A4 | |
| SCHEMBL17996823 | 0.75 | ESR1 (0.68) | ESR1ESR2DEGS1 | |
| SCHEMBL11097229 | 0.74 | ESR1 (0.54) | ESR1ESR2ACACB | |
| Hydrochloric Acid SCHEMBL11099068 | 0.74 | ESR1 (0.54) | ESR1ESR2DEGS1 | |
| SCHEMBL11101184 | 0.72 | ESR1 (0.64) | ESR1ESR2SLC6A4 | |
| SCHEMBL23153064 | 0.70 | ESR1 (0.62) | ESR1ESR2DEGS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0019739-B1 | 2-AMINOALKYL-5-PYRIDINOLES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM | CIBA-GEIGY AG (CH) | 1984-07-18 | — | — | EP | disclosed |
| US-4260619-A | ANTIISCHEMIC | CIBA-GEIGY CORPORATION (US) | 1981-04-07 | — | — | US | disclosed |
| EP-0019739-A1 | 2-Aminoalkyl-5-pyridinoles, process for their preparation and pharmaceutical preparations containing them | CIBA-GEIGY AG (CH) | 1980-12-10 | — | — | EP | disclosed |