Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | ELANE | P08246 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29740350 | 0.93 | CA12 (0.53) | ALDH1A1CA12CA9KMT2AMEN1 | |
| SCHEMBL8431420 | 0.93 | CA12 (0.53) | ALDH1A1CA12CA9KMT2AMEN1 | |
| SCHEMBL5998010 | 0.89 | ALDH1A1 (0.49) | ALDH1A1CA12CA9KMT2AMAPT | |
| SCHEMBL5998387 | 0.87 | ALDH1A1 (0.49) | ALDH1A1KMT2AMAPTMEN1 | |
| SCHEMBL9386761 | 0.85 | ALDH1A1 (0.56) | ALDH1A1CA12CA9KMT2AMAPT | |
| SCHEMBL9456474 | 0.84 | ALDH1A1 (0.54) | ALDH1A1CA12CA9KMT2AMAPT | |
| SCHEMBL4410547 | 0.84 | ALDH1A1 (0.54) | ALDH1A1CA12CA9KMT2AMAPT | |
| SCHEMBL8574998 | 0.83 | MAPK1 (0.56) | ALDH1A1CA12CA9KMT2AMAPT | |
| SCHEMBL5997212 | 0.82 | NPSR1 (0.60) | ALDH1A1CA12CA9KMT2AMAPT | |
| SCHEMBL13873450 | 0.80 | ALDH1A1 (0.54) | ALDH1A1CA12CA9KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-20090104671-A1 | METHOD FOR PRODUCING OPTICALLY ACTIVE 2-(N-SUBSTITUTED AMINOMETHYL)-3-HYDROXYBUTYRIC ACID ESTER | KANEKA CORPORATION (JP) | 2009-04-23 | — | — | US | disclosed |