Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 16/20 | 1.00 |
| ▸ | ESRRG | P62508 | 10/20 | 0.73 |
| ▸ | ESRRB | O95718 | 6/20 | 0.73 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.73 |
| ▸ | MEN1 | O00255 | 2/20 | 0.73 |
| ▸ | TP53 | P04637 | 2/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.73 |
| ▸ | MAPT | P10636 | 2/20 | 0.73 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.73 |
| ▸ | PGR | P06401 | 2/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.73 |
| ▸ | LMNA | P02545 | 1/20 | 0.73 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.73 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.73 |
| ▸ | PLD2 | O14939 | 1/20 | 0.73 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.73 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.71 |
| ▸ | ESRRA | P11474 | 2/20 | 0.64 |
| ▸ | NPC1 | O15118 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL10829107 | 1.00 | ESR1 (1.00) | ESR1ESRRGESRRBESR2MEN1 | |
| SCHEMBL17164697 | 0.94 | ESR1 (0.89) | ESR1ESRRGESRRBESR2MEN1 | |
| SCHEMBL17164708 | 0.94 | ESR1 (0.89) | ESR1ESRRGESRRBESR2MEN1 | |
| SCHEMBL18872440 | 0.90 | ESR1 (0.81) | ESR1ESRRGESRRBESR2MEN1 | |
| SCHEMBL15788576 | 0.87 | ESR1 (0.77) | ESR1ESRRGESRRBESR2MEN1 | |
| SCHEMBL15788565 | 0.87 | ESR1 (0.77) | ESR1ESRRGESRRBESR2MEN1 | |
| SCHEMBL20224018 | 0.85 | ESR1 (0.78) | ESR1ESRRGESRRBESR2MEN1 | |
| SCHEMBL4408304 | 0.85 | ESR1 (0.74) | ESR1ESRRGESRRBESR2MEN1 | |
| SCHEMBL4409444 | 0.85 | ESR1 (0.74) | ESR1ESRRGESRRBESR2MEN1 | |
| SCHEMBL2165503 | 0.84 | ESR1 (1.00) | ESR1ESRRGESRRBESR2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| 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-4623660-A | ANTIESTROGENS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1986-11-18 | — | — | US | disclosed |
| EP-0002097-B1 | TRIPHENYLALKENE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1981-08-05 | — | — | EP | disclosed |
| EP-0002097-A1 | Triphenylalkene derivatives, process for their preparation and pharmaceutical compositions containing them | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1979-05-30 | — | — | EP | disclosed |