Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.57 |
| ▸ | CA2 | P00918 | 2/20 | 0.57 |
| ▸ | CA9 | Q16790 | 2/20 | 0.57 |
| ▸ | CA5A | P35218 | 1/20 | 0.57 |
| ▸ | STS | P08842 | 7/20 | 0.54 |
| ▸ | ESR1 | P03372 | 5/20 | 0.54 |
| ▸ | HSD17B1 | P14061 | 4/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.54 |
| ▸ | SHBG | P04278 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | PGR | P06401 | 1/20 | 0.54 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | AR | P10275 | 1/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL7130255 | 0.87 | CA1 (0.74) | CA1CA2CA9CA5ASTS | |
| SCHEMBL12888972 | 0.84 | ESR1 (0.75) | STSESR1HSD17B1ESR2LMNA | |
| SCHEMBL14924234 | 0.84 | ESR1 (0.75) | STSESR1HSD17B1ESR2LMNA | |
| SCHEMBL5525067 | 0.84 | ESR1 (0.75) | STSESR1HSD17B1ESR2LMNA | |
| SCHEMBL1236350 | 0.84 | ESR1 (0.75) | STSESR1HSD17B1ESR2LMNA | |
| SCHEMBL17068938 | 0.82 | STS (0.56) | CA1CA2CA9CA5ASTS | |
| SCHEMBL15425176 | 0.82 | STS (0.56) | CA1CA2CA9CA5ASTS | |
| SCHEMBL6832730 | 0.82 | CA1 (0.52) | CA1CA2CA9CA5ASTS | |
| SCHEMBL7705116 | 0.81 | LMNA (0.77) | CA1CA2CA9STSESR1 | |
| SCHEMBL6462059 | 0.81 | LMNA (0.77) | CA1CA2CA9STSESR1 |
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-0847399-A1 | NOVEL ESTROGENS | Astra Aktiebolag (SE) | 1998-06-17 | — | — | EP | disclosed |
| WO-1997008188-A1 | NOVEL ESTROGENS | ASTRA AKTIEBOLAG (SE) | 1997-03-06 | — | — | WO | disclosed |