Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 14/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 13/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | AR | P10275 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | TYR | P14679 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | ESRRG | P62508 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7704794 | 0.82 | ESR1 (0.59) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL8770754 | 0.79 | ESR1 (0.50) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL6747031 | 0.79 | ESR1 (0.54) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL4593276 | 0.79 | ESR1 (0.60) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL7539495 | 0.78 | ESR1 (0.48) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL14411802 | 0.76 | ESR1 (0.56) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL8751432 | 0.76 | ESR1 (0.56) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL8579164 | 0.73 | ESR2 (0.57) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL9561475 | 0.72 | ESR1 (0.52) | ESR1ESR2CYP3A4LMNAAR | |
| SCHEMBL19262086 | 0.72 | ESR1 (0.52) | ESR1ESR2CYP3A4LMNAAR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1204625-A1 | PREPARATION OF 1,2-BIS(4-HYDROXYPHENYL)-2-HYDROXYPROPANES | THE DOW CHEMICAL COMPANY (US) | 2002-05-15 | — | — | EP | disclosed |
| US-6365788-B1 | DEHALOGENATION, HYDROXYLATION OF 1,2-BIS(4-HYDROXYPHENYL)-HALOGEN PROPANES WITH WATER AND AN ALKALI OR ALKALINE EARTH METAL CARBONATE OR BICARBONATE | THE DOW CHEMICAL COMPANY | 2002-04-02 | — | — | US | disclosed |
| WO-2001009071-A1 | PREPARATION OF 1,2-BIS(4-HYDROXYPHENYL)-2-HYDROXYPROPANES | THE DOW CHEMICAL COMPANY (US) | 2001-02-08 | — | — | WO | disclosed |