Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 10/20 | 0.47 |
| ▸ | ESR1 | P03372 | 8/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | ESRRG | P62508 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPY1R | P25929 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TYR | P14679 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9803912 | 0.83 | ESR2 (0.44) | ESR2ESR1CYP3A4ALDH1A1OPRM1 | |
| SCHEMBL9065614 | 0.82 | ESR2 (0.44) | ESR2ESR1CYP3A4ALDH1A1AR | |
| SCHEMBL8959239 | 0.80 | ESR1 (0.45) | ESR2ESR1CYP3A4ALDH1A1AR | |
| SCHEMBL6451587 | 0.77 | ESR1 (0.47) | ESR2ESR1CYP3A4ALDH1A1AR | |
| SCHEMBL9065610 | 0.74 | ESR1 (0.40) | ESR2ESR1CYP3A4ALDH1A1AR | |
| SCHEMBL2605554 | 0.73 | ESR2 (0.48) | ESR2ESR1CYP3A4ALDH1A1AR | |
| SCHEMBL9074756 | 0.73 | ESR1 (0.39) | ESR2ESR1CYP3A4ARHPGD | |
| SCHEMBL9065887 | 0.72 | ESR2 (0.51) | ESR2ESR1CYP3A4ALDH1A1AR | |
| SCHEMBL12606716 | 0.72 | ESR2 (0.44) | ESR2ESR1CYP3A4ALDH1A1AR | |
| SCHEMBL16581452 | 0.70 | ESR2 (0.39) | ESR2ESR1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5010163-A | Molding materials | BAYER AKTIENGESELLSCHAFT (DE) | 1991-04-23 | — | — | US | disclosed |
| EP-0374630-A2 | Polycarbonates from cyclohexylidene diphenols | BAYER AG (DE) | 1990-06-27 | — | — | EP | disclosed |