Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 8/20 | 0.68 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | AR | P10275 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.53 |
| ▸ | HTR6 | P50406 | 1/20 | 0.53 |
| ▸ | ESRRG | P62508 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | CNR1 | P21554 | 4/20 | 0.40 |
| ▸ | CNR2 | P34972 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7809653 | 0.86 | ESR1 (0.73) | ESR1ESR2CYP3A4ALDH1A1AR | |
| SCHEMBL1073585 | 0.85 | ESR1 (0.70) | ESR1ESR2CYP3A4ALDH1A1AR | |
| SCHEMBL26968 | 0.82 | ESR1 (1.00) | ESR1ESR2CYP3A4ALDH1A1AR | |
| SCHEMBL17897779 | 0.79 | ESR1 (0.61) | ESR1ESR2CYP3A4ALDH1A1AR | |
| SCHEMBL29132376 | 0.78 | ESR1 (0.60) | ESR1ESR2CYP3A4ALDH1A1AR | |
| SCHEMBL24167936 | 0.78 | ESR1 (0.84) | ESR1ESR2CYP3A4ALDH1A1AR | |
| SCHEMBL29368890 | 0.78 | ESR1 (0.84) | ESR1ESR2CYP3A4ALDH1A1AR | |
| SCHEMBL124881 | 0.78 | ESR1 (0.84) | ESR1ESR2CYP3A4ALDH1A1AR | |
| SCHEMBL1758100 | 0.78 | ESR1 (0.47) | ESR1ESR2CYP3A4ALDH1A1AR | |
| Phenol SCHEMBL1652130 | 0.77 | ESR1 (0.88) | ESR1ESR2CYP3A4ALDH1A1AR |
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-4985393-A | Bis/hydroxyphenylthio/ Compounds | KANZAKI PAPER MANUFACTURING CO., LTD. (JP) | 1991-01-15 | — | — | US | disclosed |
| EP-0373561-A2 | Heat sensitive recording material | KANZAKI PAPER MANUFACTURING CO., LTD. (JP) | 1990-06-20 | — | — | EP | disclosed |