Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.53 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.51 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.50 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.49 |
| ▸ | PGR | P06401 | 1/20 | 0.49 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.49 |
| ▸ | AR | P10275 | 1/20 | 0.49 |
| ▸ | THRA | P10827 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | PTGES | O14684 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6378 | 1.00 | TAAR1 (0.53) | TAAR1SIRT2FFAR1FFAR4L3MBTL1 | |
| SCHEMBL7109146 | 0.90 | TAAR1 (0.50) | TAAR1FFAR1FFAR4PTGES | |
| Phenyl Propionic Acid SCHEMBL28549085 | 0.90 | FFAR1 (0.59) | SIRT2FFAR1FFAR4L3MBTL1ESR1 | |
| SCHEMBL1743642 | 0.85 | FFAR1 (0.74) | FFAR1FFAR4ESR1NR3C1PGR | |
| SCHEMBL1511063 | 0.84 | CYP4F2 (0.55) | TAAR1FFAR1FFAR4L3MBTL1ESR1 | |
| SCHEMBL15504971 | 0.83 | SIRT2 (0.51) | SIRT2PTPN1 | |
| SCHEMBL26714888 | 0.83 | FFAR1 (0.50) | TAAR1FFAR1FFAR4L3MBTL1ESR1 | |
| SCHEMBL29700723 | 0.83 | SLC7A5 (0.55) | TAAR1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL136054 | 0.83 | SLC7A5 (0.55) | TAAR1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL902744 | 0.83 | L3MBTL1 (0.47) | TAAR1FFAR1FFAR4L3MBTL1ESR1 |
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-115279747-B | FYN and VEGFR2 kinase inhibitors | 罗达制药生物技术有限责任公司 | 2024-11-05 | — | — | CN | disclosed |
| CN-115279747-A | Novel fYN and VEGFR2 kinase inhibitors | 罗达制药生物技术有限责任公司 | 2022-11-01 | — | — | CN | disclosed |