Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL27715784 | 0.78 | — | — | |
| Naphthalene SCHEMBL27967608 | 0.76 | CYP2A6 (0.40) | CYP1A2CYP2C19ALDH1A1TP53MAPT | |
| Anisole SCHEMBL27835047 | 0.75 | CA4 (0.61) | ALDH1A1NPC1RAB9ALMNAMAPT | |
| Phenol SCHEMBL27621554 | 0.75 | CA12 (0.48) | CYP1A2CYP3A4CYP2C19PTGS2ALDH1A1 | |
| Diphenylether SCHEMBL9580840 | 0.75 | LTA4H (0.52) | NPC1TSHRRAB9ALMNAHPGD | |
| Aniline SCHEMBL2116683 | 0.75 | TSHR (0.48) | CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1 | |
| Methylphenylsulfide SCHEMBL4902407 | 0.75 | — | — | |
| Methylphenylsulfide SCHEMBL7584 | 0.75 | — | — | |
| Methylphenylsulfide SCHEMBL1332325 | 0.75 | — | — | |
| Methylphenylsulfide SCHEMBL27970000 | 0.75 | MAPT (0.53) | CYP1A2MEN1CYP3A4CYP2C9CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106902870-B | Functionalization material and its production technology and use | 湖北硒诺唯新功能化硅胶材料有限公司 | 2018-08-21 | — | — | CN | disclosed |
| CN-106902870-A | Functionalization material and its production technology with use | 湖北硒诺唯新功能化硅胶材料有限公司 | 2017-06-30 | — | — | CN | disclosed |
| CN-106478709-A | Replace material and its production technology and purposes | 湖北硒诺唯新功能化硅胶材料有限公司 | 2017-03-08 | — | — | CN | disclosed |