Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.59 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.57 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | PRMT1 | Q99873 | 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 | |
|---|---|---|---|---|
| SCHEMBL4252025 | 0.96 | ESR1 (0.60) | ESR1CYP19A1CYP11B2PTGS2CYP2D6 | |
| SCHEMBL14928221 | 0.96 | ESR1 (0.60) | ESR1CYP19A1CYP11B2PTGS2CYP2D6 | |
| SCHEMBL21387912 | 0.96 | ESR1 (0.60) | ESR1CYP19A1CYP11B2PTGS2CYP2D6 | |
| SCHEMBL8633334 | 0.96 | ESR1 (0.60) | ESR1CYP19A1CYP11B2PTGS2CYP2D6 | |
| SCHEMBL2210132 | 0.96 | ESR1 (0.60) | ESR1CYP19A1CYP11B2PTGS2CYP2D6 | |
| SCHEMBL23316166 | 0.96 | ESR1 (0.60) | ESR1CYP19A1CYP11B2PTGS2CYP2D6 | |
| SCHEMBL6032733 | 0.94 | CYP19A1 (0.55) | ESR1CYP19A1CYP11B2PTGS2CYP2D6 | |
| SCHEMBL133557 | 0.94 | CYP19A1 (0.55) | ESR1CYP19A1CYP11B2PTGS2CYP2D6 | |
| SCHEMBL14018365 | 0.94 | CYP19A1 (0.55) | ESR1CYP19A1CYP11B2PTGS2CYP2D6 | |
| SCHEMBL10128938 | 0.94 | CYP19A1 (0.55) | ESR1CYP19A1CYP11B2PTGS2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109705041-A | A kind of phenanthro- glyoxaline compound of triphenylamine substitution-modified by vinyl and preparation method thereof and application as electroluminescent device | 广东工业大学 | 2019-05-03 | — | — | CN | disclosed |
| JP-2009128713-A | SINGLE-LAYER ELECTROPHOTOGRAPHIC PHOTORECEPTOR AND IMAGE FORMING APPARATUS | KYOCERA MITA CORP | 2009-06-11 | — | — | JP | disclosed |