Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL11374986 | 0.82 | ESR1 (0.49) | ESR1ESR2SIGMAR1SLC6A4ADRB3 | |
| Hydrochloric Acid SCHEMBL11099544 | 0.81 | ESR1 (0.58) | ESR1ESR2SIGMAR1SLC6A4CYP2D6 | |
| Prisotinol SCHEMBL1229234 | 0.81 | ESR1 (0.58) | ESR1ESR2SLC6A4CYP2D6SLC6A2 | |
| Prisotinol SCHEMBL9626289 | 0.80 | ESR1 (0.57) | ESR1ESR2SLC6A4MAPK1CYP2D6 | |
| SCHEMBL17996823 | 0.78 | ESR1 (0.68) | ESR1ESR2HSD17B10SLC6A2 | |
| SCHEMBL11097229 | 0.78 | ESR1 (0.54) | ESR1ESR2 | |
| Hydrochloric Acid SCHEMBL11099068 | 0.78 | ESR1 (0.54) | ESR1ESR2ADRA1AOPRK1SLC6A3 | |
| SCHEMBL23153064 | 0.77 | ESR1 (0.62) | ESR1ESR2ADRA1ALMNAMAPT | |
| SCHEMBL11126700 | 0.76 | ESR1 (0.53) | ESR1ESR2SLC6A4 | |
| SCHEMBL11101184 | 0.75 | ESR1 (0.64) | ESR1ESR2SLC6A4HTR2AADRA2C |
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 |
| US-4260619-A | ANTIISCHEMIC | CIBA-GEIGY CORPORATION (US) | 1981-04-07 | — | — | US | disclosed |