Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 7/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 7/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CDC42 | P60953 | 1/20 | 0.44 |
| ▸ | RAC1 | P63000 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9333423 | 0.84 | AKR1C3 (0.43) | AKR1C3AKR1C2PTGS1PTGS2CDC42 | |
| SCHEMBL9333964 | 0.84 | AKR1C3 (0.43) | AKR1C3AKR1C2PTGS1PTGS2CDC42 | |
| SCHEMBL220266 | 0.83 | AKR1C3 (0.47) | AKR1C3AKR1C2PTGS1PTGS2TSHR | |
| SCHEMBL9330830 | 0.82 | AKR1C3 (0.42) | AKR1C3AKR1C2PTGS1PTGS2TSHR | |
| SCHEMBL9330626 | 0.82 | AKR1C3 (0.42) | AKR1C3AKR1C2PTGS1PTGS2TSHR | |
| SCHEMBL221552 | 0.81 | PPARA (0.45) | AKR1C3AKR1C2PTGS1CYP1A2KDM4E | |
| SCHEMBL9330648 | 0.81 | GAA (0.43) | AKR1C3AKR1C2PTGS1CYP1A2KDM4E | |
| Hydrochloric Acid SCHEMBL220256 | 0.81 | AKR1C3 (0.44) | AKR1C3AKR1C2PTGS1PTGS2TSHR | |
| SCHEMBL506525 | 0.80 | AKR1C3 (0.49) | AKR1C3AKR1C2PTGS1PTGS2TSHR | |
| SCHEMBL220299 | 0.80 | AKR1C3 (0.43) | AKR1C3AKR1C2PTGS1PTGS2TSHR |
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-0330217-B1 | Process for the continuous biotechnological preparation of optical isomer S(+) of 2-(6-methoxy-2-naphthyl)propionic acid | ENICHEM SPA (IT) | 1994-04-20 | — | — | EP | claimed |