Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 14/20 | 0.62 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.62 |
| ▸ | ESR2 | Q92731 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4665812 | 0.93 | ESR1 (0.60) | ESR1CYP19A1ESR2 | |
| SCHEMBL4665849 | 0.90 | ESR1 (0.77) | ESR1CYP19A1ESR2 | |
| SCHEMBL4667736 | 0.88 | ESR1 (0.58) | ESR1CYP19A1ESR2 | |
| SCHEMBL3810919 | 0.86 | ESR1 (0.74) | ESR1CYP19A1ESR2 | |
| SCHEMBL4796083 | 0.83 | ESR1 (0.53) | ESR1CYP19A1ESR2 | |
| SCHEMBL4665856 | 0.82 | CYP19A1 (0.60) | ESR1CYP19A1ESR2 | |
| SCHEMBL4891913 | 0.81 | ESR1 (0.56) | ESR1CYP19A1ESR2 | |
| SCHEMBL4665843 | 0.81 | ESR1 (0.53) | ESR1CYP19A1ESR2 | |
| SCHEMBL4666272 | 0.81 | ESR1 (0.57) | ESR1CYP19A1ESR2 | |
| SCHEMBL4667638 | 0.80 | ESR1 (0.51) | ESR1CYP19A1ESR2 |
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-1951216-A2 | CHEMICAL COMPOUNDS | SmithKline Beecham Corporation (US) | 2008-08-06 | — | — | EP | disclosed |
| WO-2007062145-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-05-31 | — | — | WO | disclosed |