Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 4/20 | 0.77 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL263474 | 0.93 | GABRA1 (0.73) | GABRA1GABRB2ALDH1A1TRPA1KDM4E | |
| SCHEMBL31229333 | 0.93 | GABRA1 (0.73) | GABRA1GABRB2ALDH1A1TRPA1KDM4E | |
| SCHEMBL12856364 | 0.90 | GABRA1 (0.68) | GABRA1GABRB2ALDH1A1TRPA1KDM4E | |
| SCHEMBL13839296 | 0.90 | GABRA1 (0.68) | GABRA1GABRB2ALDH1A1TRPA1KDM4E | |
| SCHEMBL199730 | 0.88 | GABRA1 (1.00) | GABRA1GABRB2CA2ESR1ESR2 | |
| Water SCHEMBL28947715 | 0.83 | GABRA1 (0.90) | GABRA1GABRB2ALDH1A1 | |
| Alcohol SCHEMBL28268569 | 0.83 | GABRA1 (0.90) | GABRA1GABRB2ALDH1A1PTGS2 | |
| SCHEMBL15979586 | 0.83 | GABRA1 (0.59) | GABRA1GABRB2ALDH1A1TRPA1KDM4E | |
| Propane SCHEMBL11575912 | 0.83 | ALDH1A1 (0.82) | GABRA1GABRB2ALDH1A1TRPA1KDM4E | |
| Propane SCHEMBL27536178 | 0.83 | ALDH1A1 (0.82) | GABRA1GABRB2ALDH1A1TRPA1KDM4E |
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-0259746-B1 | PROCESS FOR PRODUCING 2,2-BIS(4'-HYDROXYPHENYL) PROPANES | IDEMITSU PETROCHEMICAL CO. LTD. (JP) | 1991-05-15 | — | — | EP | disclosed |
| US-4814520-A | CONDENSATION OF UNSATURATED COMPOUND AND PHENOL | IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) | 1989-03-21 | — | — | US | disclosed |
| EP-0259746-A1 | Process for producing 2,2-bis(4'-hydroxyphenyl) propanes | IDEMITSU PETROCHEMICAL CO. LTD. (JP) | 1988-03-16 | — | — | EP | disclosed |