Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRB | O95718 | 8/20 | 1.00 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.73 |
| ▸ | ESR1 | P03372 | 14/20 | 0.71 |
| ▸ | ESRRG | P62508 | 11/20 | 0.68 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.68 |
| ▸ | MEN1 | O00255 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 1/20 | 0.68 |
| ▸ | TP53 | P04637 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | MAPT | P10636 | 1/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.68 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.68 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.68 |
| ▸ | PLD2 | O14939 | 1/20 | 0.68 |
| ▸ | PGR | P06401 | 1/20 | 0.68 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.68 |
| ▸ | ESRRA | P11474 | 2/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL10016265 | 1.00 | ESRRB (1.00) | ESRRBCYP19A1ESR1ESRRGESR2 | |
| SCHEMBL639037 | 0.87 | ESRRB (0.77) | ESRRBCYP19A1ESR1ESRRGESR2 | |
| SCHEMBL639038 | 0.87 | ESRRB (0.77) | ESRRBCYP19A1ESR1ESRRGESR2 | |
| SCHEMBL639036 | 0.87 | ESRRB (0.77) | ESRRBCYP19A1ESR1ESRRGESR2 | |
| SCHEMBL638915 | 0.87 | ESRRB (1.00) | ESRRBCYP19A1ESR1ESRRGESR2 | |
| SCHEMBL638891 | 0.87 | ESRRB (1.00) | ESRRBCYP19A1ESR1ESRRGESR2 | |
| SCHEMBL638890 | 0.87 | ESRRB (1.00) | ESRRBCYP19A1ESR1ESRRGESR2 | |
| SCHEMBL936134 | 0.86 | ESRRB (0.75) | ESRRBESR1ESRRGESR2KDM4E | |
| SCHEMBL10829107 | 0.83 | ESR1 (1.00) | ESRRBCYP19A1ESR1ESRRGESR2 | |
| SCHEMBL10048291 | 0.83 | ESR1 (1.00) | ESRRBCYP19A1ESR1ESRRGESR2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8119695-B2 | Compounds and methods for treating breast cancer and other diseases | CITY OF HOPE (US) | 2012-02-21 | — | — | US | disclosed |
| US-20090176305-A1 | COMPOUNDS AND METHODS FOR TREATING BREAST CANCER AND OTHER DISEASES | CITY OF HOPE | 2009-07-09 | — | — | US | disclosed |
| US-7531578-B2 | Acetic acid 4-{1-[4-(2-dimethylamino-ethoxy)-phenyl]-2-phenyl-but-1-enyl}-phenyl ester; estrogen related receptor (ERR beta or ERR gamma) antagonist; thirty times more effective than 4-hydroxytamoxifen | CITY OF HOPE (US) | 2009-05-12 | — | — | US | disclosed |
| US-7531578-B2 | Acetic acid 4-{1-[4-(2-dimethylamino-ethoxy)-phenyl]-2-phenyl-but-1-enyl}-phenyl ester; estrogen related receptor (ERR beta or ERR gamma) antagonist; thirty times more effective than 4-hydroxytamoxifen | CITY OF HOPE (US) | 2009-05-12 | — | — | US | disclosed |