Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ABCC9 | O60706 | 2/20 | 0.34 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28288711 | 0.81 | ALDH1A1 (0.39) | CES1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6509810 | 0.81 | CES1 (0.44) | CES1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL27723868 | 0.71 | CYP1B1 (0.40) | ALDH1A1MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28018043 | 0.71 | TAAR1 (0.41) | CYP1A2CYP2C19MTNR1AMTNR1B | |
| SCHEMBL18918223 | 0.71 | CES1 (0.36) | CES1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4585844 | 0.70 | RAB9A (0.39) | ALDH1A1MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL496557 | 0.69 | ALDH1A1 (0.44) | CES1ALDH1A1MAPTCYP1A2CYP2C9 | |
| SCHEMBL28655616 | 0.69 | CES1 (0.50) | CES1ALDH1A1MAPTNPSR1PTGS2 | |
| SCHEMBL15447628 | 0.69 | ALDH1A1 (0.39) | ALDH1A1MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL10604768 | 0.68 | CES1 (0.41) | CES1ALDH1A1NPSR1TDP1TSHR |
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-108003032-A | It is a kind of（1,1- bis-fluoro ethyls）Diphenyl ethylene derivatives and its preparation method and application | 上海应用技术大学 | 2018-05-08 | — | — | CN | claimed |
| CN-108003032-A | It is a kind of（1,1- bis-fluoro ethyls）Diphenyl ethylene derivatives and its preparation method and application | 上海应用技术大学 | 2018-05-08 | — | — | CN | disclosed |