Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 13/20 | 0.47 |
| ▸ | ABCC4 | O15439 | 3/20 | 0.47 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | CA6 | P23280 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12826524 | 0.84 | STS (0.61) | STSCA1CA2CA9ESR1 | |
| SCHEMBL6569001 | 0.82 | LMNA (0.60) | STSABCC4ABCC1KDM4ECA1 | |
| SCHEMBL25529639 | 0.82 | LMNA (0.60) | STSABCC4ABCC1KDM4ECA1 | |
| SCHEMBL5499832 | 0.80 | KDM4E (0.43) | STSABCC4ABCC1KDM4ECA1 | |
| SCHEMBL5496755 | 0.79 | STS (0.40) | STSABCC4ABCC1KDM4ECA1 | |
| SCHEMBL22448486 | 0.78 | LMNA (0.59) | STSABCC4ABCC1KDM4ECA1 | |
| SCHEMBL773508 | 0.77 | ESR1 (0.46) | STSABCC4ABCC1KDM4ECA1 | |
| SCHEMBL773507 | 0.77 | ESR1 (0.46) | STSABCC4ABCC1KDM4ECA1 | |
| SCHEMBL17531381 | 0.74 | STS (0.82) | STSABCC4ABCC1KDM4ECA1 | |
| SCHEMBL8034430 | 0.74 | STS (0.82) | STSABCC4ABCC1KDM4ECA1 |
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-2616477-A2 | 6-SUBSTITUTED DEMETHYL-ESTRADIOL DERIVATIVES AS ER-BETA AGONISTS | Endece, LLC (US) | 2013-07-24 | — | — | EP | disclosed |
| WO-2012037261-A2 | 6-SUBSTITUTED DEMETHYL-ESTRADIOL DERIVATIVES AS ER-BETA AGONISTS | ENDECE, LLC (US) | 2012-03-22 | — | — | WO | disclosed |