Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9159698 | 0.84 | ALDH1A1 (0.33) | ALDH1A1TSHREPHX1POLB | |
| SCHEMBL2326421 | 0.78 | MAPT (0.36) | ALDH1A1 | |
| SCHEMBL608378 | 0.74 | KDM4C (0.31) | — | |
| SCHEMBL21605368 | 0.73 | PIK3CD (0.35) | TP53EPHX1POLB | |
| SCHEMBL11686026 | 0.71 | EPHX1 (0.39) | ALDH1A1EPHX1 | |
| SCHEMBL7611989 | 0.71 | ALDH1A1 (0.38) | TP53ALDH1A1TSHR | |
| SCHEMBL11683699 | 0.71 | EPHX1 (0.39) | ALDH1A1EPHX1 | |
| SCHEMBL11686016 | 0.68 | PIK3CD (0.32) | EPHX1POLB | |
| SCHEMBL9333241 | 0.68 | CNR2 (0.33) | ALDH1A1EPHX1POLB | |
| SCHEMBL10493720 | 0.67 | TSHR (0.40) | ALDH1A1TSHREPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20090104671-A1 | METHOD FOR PRODUCING OPTICALLY ACTIVE 2-(N-SUBSTITUTED AMINOMETHYL)-3-HYDROXYBUTYRIC ACID ESTER | KANEKA CORPORATION (JP) | 2009-04-23 | — | — | US | disclosed |
| EP-1908845-A1 | METHOD FOR PRODUCING OPTICALLY ACTIVE 2-(N-SUBSTITUTED AMINOMETHYL)-3-HYDROXYBUTYRIC ACID ESTER | Kaneka Corporation (JP) | 2008-04-09 | — | — | EP | disclosed |