Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | PDE2A | O00408 | 3/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL151287 | 0.81 | CES2 (0.50) | CES2TAS2R14KDM4EALDH1A1HPGD | |
| SCHEMBL31064612 | 0.81 | CES2 (0.50) | CES2TAS2R14KDM4EALDH1A1HPGD | |
| SCHEMBL16956845 | 0.81 | CES2 (0.39) | CES2TAS2R14KDM4EALDH1A1HPGD | |
| SCHEMBL17141748 | 0.79 | MEN1 (0.43) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28987801 | 0.78 | CES2 (0.42) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL14533723 | 0.78 | JAK2 (0.47) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11542009 | 0.77 | NPC1 (0.38) | ALDH1A1SMN1; SMN2NPSR1MAPTCYP2C9 | |
| SCHEMBL18611579 | 0.77 | CES2 (0.44) | CES2TAS2R14KDM4EALDH1A1HPGD | |
| SCHEMBL28412823 | 0.76 | CES2 (0.41) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL475120 | 0.76 | TAS2R14 (0.59) | CES2TAS2R14KDM4EALDH1A1HPGD |
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-111171068-B | Preparation method of silicon spiro-compound | 中国科学院上海有机化学研究所 | 2021-12-14 | — | — | CN | disclosed |
| CN-111171068-A | Preparation method of silicon spiro-compound | 中国科学院上海有机化学研究所 | 2020-05-19 | — | — | CN | disclosed |