Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 15/20 | 0.62 |
| ▸ | ESR2 | Q92731 | 15/20 | 0.62 |
| ▸ | HSD17B3 | P37058 | 5/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8622933 | 0.92 | ESR1 (0.64) | ESR1ESR2HSD17B3 | |
| SCHEMBL16685069 | 0.88 | ESR1 (0.50) | ESR1ESR2HSD17B3 | |
| SCHEMBL2566604 | 0.82 | HSD17B3 (0.47) | ESR1ESR2HSD17B3 | |
| SCHEMBL11994148 | 0.82 | HTR7 (0.50) | ESR1ESR2 | |
| SCHEMBL2566602 | 0.82 | HSD17B3 (0.47) | ESR1ESR2HSD17B3 | |
| SCHEMBL6897257 | 0.82 | SIGMAR1 (0.54) | ESR1ESR2 | |
| SCHEMBL16685238 | 0.82 | ESR1 (0.46) | ESR1ESR2 | |
| SCHEMBL14288468 | 0.81 | ESR1 (0.50) | ESR1ESR2 | |
| SCHEMBL16685139 | 0.80 | ESR1 (0.44) | ESR1ESR2 | |
| SCHEMBL16684967 | 0.80 | TBXAS1 (0.51) | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1951217-A4 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORP (US) | 2009-08-12 | — | — | EP | claimed |
| EP-1951217-A2 | CHEMICAL COMPOUNDS | SmithKline Beecham Corporation (US) | 2008-08-06 | — | — | EP | claimed |
| WO-2007062148-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2007-05-31 | — | — | WO | claimed |
| EP-3063158-A1 | METALLOCENE DERIVATIVES WITH ANTICANCER ACTIVITY | Paris Sciences et Lettres - Quartier Latin (FR) | 2016-09-07 | — | — | EP | disclosed |
| WO-2015063201-A1 | METALLOCENE DERIVATIVES WITH ANTICANCER ACTIVITY | PARIS SCIENCES ET LETTRES - QUARTIER LATIN (FR) | 2015-05-07 | — | — | WO | disclosed |