Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5540795 | 0.72 | ALDH1A1 (0.33) | CA12CA1CA2CA9MAPK1 | |
| SCHEMBL443306 | 0.72 | CA12 (0.56) | CA12CA1CA2CA9MAPK1 | |
| Ethyl Propionate SCHEMBL28302629 | 0.71 | — | — | |
| Ethyl Propionate SCHEMBL1332690 | 0.71 | — | — | |
| Ethyl Propionate SCHEMBL4883389 | 0.71 | — | — | |
| Ethyl Propionate SCHEMBL16045 | 0.71 | — | — | |
| Ethyl Propionate SCHEMBL1868177 | 0.71 | GAA (0.67) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL23028585 | 0.70 | NAAA (0.38) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL4123314 | 0.70 | MAPT (0.47) | CA12CA1CA2CA9MAPK1 | |
| Ethyl Propionate SCHEMBL4449050 | 0.69 | — | — |
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-110078752-A | A kind of 5- Aminotetrazole propionic acid-Ce (III) complex and its preparation method and application | 常熟理工学院 | 2019-08-02 | — | — | CN | claimed |
| CN-110078752-A | A kind of 5- Aminotetrazole propionic acid-Ce (III) complex and its preparation method and application | 常熟理工学院 | 2019-08-02 | — | — | CN | disclosed |