Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9819031 | 0.84 | NPC1 (0.45) | ALDH1A1GAAKMT2AMAPTKDM4E | |
| SCHEMBL9589020 | 0.81 | AKR1B1 (0.53) | ALDH1A1MAPTKDM4ENPC1RAB9A | |
| SCHEMBL10647002 | 0.81 | AKR1B1 (0.53) | ALDH1A1MAPTKDM4ENPC1RAB9A | |
| SCHEMBL9591095 | 0.81 | AKR1B1 (0.53) | ALDH1A1MAPTKDM4ENPC1RAB9A | |
| SCHEMBL10571022 | 0.78 | AKR1B1 (0.39) | ALDH1A1GAAKMT2AMAPTMEN1 | |
| Phenethylamine SCHEMBL11073571 | 0.77 | AKR1B1 (0.46) | ALDH1A1KMT2AMAPTMEN1NPC1 | |
| Phenethylamine SCHEMBL11073573 | 0.77 | AKR1B1 (0.46) | ALDH1A1KMT2AMAPTMEN1NPC1 | |
| SCHEMBL28766442 | 0.75 | NPC1 (0.38) | ALDH1A1GAAKMT2AMAPTKDM4E | |
| SCHEMBL10759714 | 0.74 | KMT2A (0.39) | ALDH1A1GAAKMT2AMAPTKDM4E | |
| SCHEMBL10755930 | 0.74 | SMN1; SMN2 (0.41) | ALDH1A1GAAMAPTKDM4ENPC1 |
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-4812406-A | BY STEREO-SELECTIVE ENZYMATIC REACTION | KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1989-03-14 | — | — | US | claimed |
| EP-0175312-A2 | Process for preparing optically active hydantoins | KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1986-03-26 | — | — | EP | claimed |