Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15701852 | 0.85 | GRM2 (0.49) | ERN1CYP1A2CYP2A6MAPTCYP2C9 | |
| SCHEMBL9857438 | 0.84 | CYP1A2 (0.49) | ERN1CYP1A2CYP2A6MAPTCYP2C9 | |
| SCHEMBL808500 | 0.83 | ERN1 (0.64) | ERN1CYP1A2CYP2A6MAPTCYP2C9 | |
| SCHEMBL29391032 | 0.83 | ERN1 (0.64) | ERN1CYP1A2CYP2A6MAPTCYP2C9 | |
| SCHEMBL26661895 | 0.82 | ERN1 (0.45) | ERN1CYP1A2CYP2A6MAPTCYP2C9 | |
| SCHEMBL9856910 | 0.79 | CYP1A2 (0.42) | ERN1CYP1A2CYP2A6MAPTCYP2C9 | |
| SCHEMBL22871880 | 0.77 | ERN1 (0.49) | ERN1CYP1A2CYP2A6MAPTCYP2C9 | |
| SCHEMBL6548332 | 0.76 | CA12 (0.54) | CYP1A2CYP2A6MAPTTDP1GAA | |
| SCHEMBL230035 | 0.76 | ERN1 (0.60) | ERN1CYP1A2CYP2A6MAPTCYP2C9 | |
| SCHEMBL29357470 | 0.76 | ERN1 (0.60) | ERN1CYP1A2CYP2A6MAPTCYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0426846-A1 | FLUORINATED-AROMATIC SULFONIC ACID CATALYST, PROCESS FOR ITS PRODUCTION, AND ITS USE | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1991-05-15 | — | — | EP | disclosed |