Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.57 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.57 |
| ▸ | ESRRA | P11474 | 7/20 | 0.55 |
| ▸ | ESRRB | O95718 | 6/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.50 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.50 |
| ▸ | PGR | P06401 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.50 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.50 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1705556 | 0.96 | ESR1 (0.54) | ESR1ESR2ESRRAESRRBHDAC3 | |
| SCHEMBL13018851 | 0.96 | ESR1 (0.54) | ESR1ESR2ESRRAESRRBHDAC3 | |
| SCHEMBL23424229 | 0.84 | ESR1 (0.75) | ESR1ESR2ESRRAESRRBHDAC3 | |
| SCHEMBL15884186 | 0.84 | ESRRA (0.52) | ESR1ESR2ESRRAESRRBHDAC3 | |
| SCHEMBL23424204 | 0.84 | ESR1 (0.55) | ESR1ESR2ESRRAESRRBHDAC3 | |
| SCHEMBL10804557 | 0.83 | CYP1A1 (0.54) | ESR1ESR2ESRRAESRRBHDAC3 | |
| SCHEMBL23765686 | 0.83 | ESR1 (0.60) | ESR1ESR2ESRRAESRRBHDAC3 | |
| SCHEMBL23765855 | 0.83 | ESR1 (0.62) | ESR1ESR2ESRRAESRRBHDAC3 | |
| SCHEMBL23765691 | 0.82 | ESR1 (0.61) | ESR1ESR2ESRRAESRRBHDAC3 | |
| SCHEMBL16267060 | 0.82 | ESR1 (0.66) | ESR1ESR2ESRRAESRRBHDAC3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023105303-A1 | COMPOUNDS FOR THE TREATMENT OF CANCER | KASHIV BIOSCIENCES, LLC (US) | 2023-06-15 | — | — | WO | disclosed |