Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 3/20 | 0.53 |
| ▸ | EDNRB | P24530 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9258771 | 0.98 | EDNRA (0.54) | EDNRAEDNRBTSHRCES2CES1 | |
| SCHEMBL6229779 | 0.98 | EDNRA (0.54) | EDNRAEDNRBTSHRCES2CES1 | |
| SCHEMBL6228156 | 0.98 | EDNRA (0.54) | EDNRAEDNRBTSHRCES2CES1 | |
| SCHEMBL7293698 | 0.98 | EDNRA (0.54) | EDNRAEDNRBTSHRCES2CES1 | |
| SCHEMBL7144597 | 0.98 | EDNRA (0.54) | EDNRAEDNRBTSHRCES2CES1 | |
| SCHEMBL7410333 | 0.83 | ELANE (0.50) | TSHREPHX1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL8503544 | 0.82 | BACE1 (0.52) | EDNRAEDNRBTSHRCES2CES1 | |
| SCHEMBL3201276 | 0.82 | BACE1 (0.52) | EDNRAEDNRBTSHRCES2CES1 | |
| SCHEMBL8079337 | 0.82 | PARP10 (0.48) | EDNRAEDNRBTSHRCES2CES1 | |
| SCHEMBL8577007 | 0.82 | PARP10 (0.48) | EDNRAEDNRBTSHRCES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-9255673-A | — | — | None | — | — | JP | disclosed |
| JP-H09255673-A | PRODUCTION OF OPTICALLY ACTIVE 3-(PARAMETHOXYPHENYL) GRYCIDIC ACID ALKALI METAL SALT | SHIONOGI & CO LTD | 1997-09-30 | — | — | JP | disclosed |