Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | GPR88 | Q9GZN0 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7919741 | 1.00 | ATM (0.53) | ATML3MBTL1KCNQ2CYP1A2CYP3A4 | |
| SCHEMBL7913426 | 0.90 | ATM (0.50) | ATML3MBTL1CYP3A4GPR88TDP1 | |
| SCHEMBL10913216 | 0.89 | ATM (0.49) | ATML3MBTL1GPR88 | |
| SCHEMBL5146647 | 0.88 | ATM (0.48) | ATML3MBTL1 | |
| SCHEMBL10782796 | 0.88 | ATM (0.48) | ATML3MBTL1 | |
| SCHEMBL10783816 | 0.88 | ATM (0.48) | ATML3MBTL1 | |
| SCHEMBL10954043 | 0.88 | ATM (0.48) | ATML3MBTL1 | |
| SCHEMBL10953711 | 0.88 | ATM (0.48) | ATML3MBTL1 | |
| SCHEMBL10911342 | 0.88 | ATM (0.48) | ATML3MBTL1 | |
| SCHEMBL10779120 | 0.88 | ATM (0.48) | ATML3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111620781-B | Alpha-alkyl phenylacetic acid compound with high optical activity and preparation method and application thereof | 南京工业大学 | 2021-05-25 | — | — | CN | disclosed |
| CN-111620781-A | Alpha-alkyl phenylacetic acid compound with high optical activity and preparation method and application thereof | 南京工业大学 | 2020-09-04 | — | — | CN | disclosed |