Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CASR | P41180 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10840083 | 0.80 | ESR1 (0.39) | CYP3A4 | |
| SCHEMBL10837628 | 0.76 | TSHR (0.40) | CASR | |
| SCHEMBL10839864 | 0.75 | ESR1 (0.41) | PTPN1CYP2A6CYP1A2CASRCYP3A4 | |
| SCHEMBL10838789 | 0.73 | CYP19A1 (0.41) | — | |
| SCHEMBL10839869 | 0.70 | ESR1 (0.55) | PTPN1CYP2A6CYP1A2CASRCYP3A4 | |
| SCHEMBL28297057 | 0.67 | PTPN1 (0.48) | PTPN1CYP2A6CYP1A2CASRCYP3A4 | |
| SCHEMBL599567 | 0.67 | PTPN1 (0.48) | PTPN1CYP2A6CYP1A2CASRCYP3A4 | |
| SCHEMBL30222062 | 0.67 | PTPN1 (0.48) | PTPN1CYP2A6CYP1A2CASRCYP3A4 | |
| SCHEMBL237505 | 0.66 | ESR1 (0.64) | PTPN1CYP2A6CYP1A2CASRCYP3A4 | |
| SCHEMBL29672349 | 0.66 | ESR1 (0.64) | PTPN1CYP2A6CYP1A2CASRCYP3A4 |
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-4622380-A | Alkylidene bromo-substituted arylene acetal and/or ketal polymers | PPG INDUSTRIES, INC. (US) | 1986-11-11 | — | — | US | disclosed |
| US-4489189-A | FROM TETRABROMOBISPHENOL A AND ETHYLENE GLYCOL | PPG INDUSTRIES, INC. (US) | 1984-12-18 | — | — | US | disclosed |