Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1605255 | 0.83 | ALDH1A1 (0.39) | PTPN1POLBMEN1KMT2ATDP1 | |
| SCHEMBL28849693 | 0.81 | ALDH1A1 (0.36) | PTPN1MEN1KMT2AMAPTTDP1 | |
| Benzene SCHEMBL28263391 | 0.81 | ALDH1A1 (0.38) | POLBMEN1KMT2ATDP1CYP1A2 | |
| Naphthalene SCHEMBL9538913 | 0.72 | ALDH1A1 (0.53) | MEN1KMT2AMAPTTDP1GAA | |
| Propionaldehyde SCHEMBL28030448 | 0.71 | ALDH1A1 (0.41) | TDP1GAAL3MBTL1CYP1A2ALDH1A1 | |
| Naphthalene SCHEMBL27832233 | 0.70 | ALDH1A1 (0.50) | MEN1KMT2AMAPTTDP1GAA | |
| SCHEMBL1613704 | 0.69 | PTPN1 (0.36) | PTPN1POLBMEN1KMT2AMAPT | |
| Propionaldehyde SCHEMBL27544772 | 0.68 | ALDH1A1 (0.47) | TDP1GAAL3MBTL1CYP1A2CYP2C19 | |
| Anthracene SCHEMBL27589704 | 0.68 | ALDH1A1 (0.47) | MEN1KMT2AMAPTTDP1GAA | |
| Propionaldehyde SCHEMBL27932171 | 0.67 | CYP2A6 (0.68) | TDP1GAAL3MBTL1CYP1A2CYP2C19 |
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-107188837-B | A kind of synthetic method of α-acyl group high allyl thio-ether type compounds | 温州大学 | 2019-05-28 | — | — | CN | disclosed |
| CN-107188837-A | A kind of synthetic method of α acyl groups high allyl thio-ether type compounds | 温州大学 | 2017-09-22 | — | — | CN | disclosed |