Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.54 |
| ▸ | ACACB | O00763 | 14/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11097016 | 0.81 | ACACB (0.48) | ACACBMTNR1AMTNR1B | |
| Hydrochloric Acid SCHEMBL11099544 | 0.79 | ESR1 (0.58) | ESR1ESR2 | |
| Prisotinol SCHEMBL1229234 | 0.79 | ESR1 (0.58) | ESR1ESR2 | |
| Prisotinol SCHEMBL9626289 | 0.78 | ESR1 (0.57) | ESR1ESR2 | |
| SCHEMBL11128368 | 0.78 | ESR1 (0.57) | ESR1ESR2 | |
| SCHEMBL8385587 | 0.76 | ACACB (0.56) | ACACBMTNR1AMTNR1B | |
| SCHEMBL8385561 | 0.76 | ACACB (0.56) | ACACBMTNR1AMTNR1B | |
| SCHEMBL11989413 | 0.76 | ACACB (0.56) | ACACBMTNR1AMTNR1B | |
| SCHEMBL17996823 | 0.76 | ESR1 (0.68) | ESR1ESR2 | |
| Prisotinol SCHEMBL9625103 | 0.76 | ESR1 (0.48) | ESR1ESR2 |
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 2 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 |
| 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 |