Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | PTPRC | P08575 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9181053 | 1.00 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1GLAMAPTNPSR1 | |
| SCHEMBL1833246 | 0.96 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1GLAMAPTNPSR1 | |
| SCHEMBL1838148 | 0.88 | ALDH1A1 (0.54) | ALDH1A1L3MBTL1GLAMAPTNPSR1 | |
| SCHEMBL15417591 | 0.87 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1GLAMAPTNPSR1 | |
| SCHEMBL30023141 | 0.87 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1GLAMAPTNPSR1 | |
| SCHEMBL30171081 | 0.86 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1GLAMAPTNPSR1 | |
| SCHEMBL20873232 | 0.86 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1GLAMAPTNPSR1 | |
| Bromide SCHEMBL30432008 | 0.84 | CYP1A2 (0.40) | ALDH1A1L3MBTL1MAPTNPSR1TDP1 | |
| SCHEMBL10456909 | 0.84 | CYP1A2 (0.51) | ALDH1A1L3MBTL1MAPTTDP1CYP3A4 | |
| SCHEMBL19553639 | 0.83 | LTA4H (0.51) | ALDH1A1L3MBTL1MAPTNPSR1TDP1 |
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-117282465-A | Synthesis method of 2, 4-hexadienal | 江西香海生物科技有限公司 | 2023-12-26 | — | — | CN | claimed |
| CN-117282465-A | Synthesis method of 2, 4-hexadienal | 江西香海生物科技有限公司 | 2023-12-26 | — | — | CN | disclosed |