Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.56 |
| ▸ | PKM | P14618 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SRR | Q9GZT4 | 2/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ALPI | P09923 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | XIAP | P98170 | 1/20 | 0.43 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8312172 | 0.85 | ALDH1A1 (0.53) | CYP1A2PKMLMNASRRNPC1 | |
| SCHEMBL28015169 | 0.84 | TDP1 (0.46) | CYP1A2SRRNPC1RAB9ATRPA1 | |
| SCHEMBL7292748 | 0.83 | PKM (0.54) | CYP1A2PKMSMN1; SMN2CYP2D6NPSR1 | |
| SCHEMBL22911682 | 0.83 | PKM (0.54) | CYP1A2PKMSMN1; SMN2CYP2D6NPSR1 | |
| SCHEMBL21149836 | 0.81 | EPHX1 (0.47) | CYP1A2PKMCYP2D6SRREPHX1 | |
| SCHEMBL16476537 | 0.78 | CYP1A2 (0.56) | CYP1A2PKMSMN1; SMN2CYP2D6NPSR1 | |
| Solriamfetol SCHEMBL42525 | 0.78 | PKM (0.56) | CYP1A2PKMSMN1; SMN2CYP2D6NPSR1 | |
| Solriamfetol SCHEMBL30929349 | 0.78 | PKM (0.56) | CYP1A2PKMSMN1; SMN2CYP2D6NPSR1 | |
| SCHEMBL375857 | 0.78 | CYP1A2 (0.56) | CYP1A2PKMSMN1; SMN2CYP2D6NPSR1 | |
| Solriamfetol SCHEMBL30929348 | 0.78 | PKM (0.56) | CYP1A2PKMSMN1; SMN2CYP2D6NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0385456-B1 | High surface hardness transparent resin and polymerizable monomer | MITSUI TOATSU CHEMICALS (JP) | 1996-09-04 | — | — | EP | disclosed |
| US-5084538-A | HIGH SURFACE HARDNESS TRANSPARENT RESIN PREPARED FROM A COMPOUND HAVING AT LEAST ONE ISOPROPENYL PHENYL GROUP | MITSUI TOATSU CHEMICALS, INC. (JP) | 1992-01-28 | — | — | US | disclosed |