Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 17/20 | 0.58 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | SULT1A1 | P50225 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16346118 | 0.92 | ESR1 (0.52) | ESR1 | |
| SCHEMBL30898315 | 0.92 | ESR1 (0.52) | ESR1 | |
| SCHEMBL18150143 | 0.92 | ESR1 (0.67) | ESR1 | |
| SCHEMBL18150144 | 0.88 | ESR1 (0.49) | ESR1APPSULT1A1 | |
| SCHEMBL28445468 | 0.79 | APP (0.48) | ESR1APP | |
| SCHEMBL30610954 | 0.79 | ESR1 (0.60) | ESR1APPSULT1A1 | |
| SCHEMBL19143729 | 0.79 | ESR1 (0.60) | ESR1APPSULT1A1 | |
| SCHEMBL20425311 | 0.79 | ESR1 (0.60) | ESR1APPSULT1A1 | |
| SCHEMBL31683627 | 0.77 | ESR1 (0.81) | ESR1 | |
| SCHEMBL8631942 | 0.77 | ESR1 (0.81) | ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107406424-B | Estrogen receptor modulators and uses thereof | 豪夫迈·罗氏有限公司 | 2020-08-25 | — | — | CN | disclosed |
| EP-3233828-A1 | ESTROGEN RECEPTOR MODULATORS AND USES THEREOF | F. Hoffmann-La Roche AG (CH) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016097071-A1 | ESTROGEN RECEPTOR MODULATORS AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2016-06-23 | — | — | WO | disclosed |