Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.85 |
| ▸ | GAA | P10253 | 6/20 | 0.85 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL30731679 | 0.92 | ALDH1A1 (1.00) | ALDH1A1GAAKDM4ESMN1; SMN2LMNA | |
| SCHEMBL28305751 | 0.87 | ALDH1A1 (0.61) | ALDH1A1GAAKDM4ESMN1; SMN2LMNA | |
| SCHEMBL30731742 | 0.85 | ALDH1A1 (0.85) | ALDH1A1GAAKDM4ESMN1; SMN2LMNA | |
| SCHEMBL28304642 | 0.84 | ALDH1A1 (0.88) | ALDH1A1GAAKDM4ESMN1; SMN2LMNA | |
| SCHEMBL28304646 | 0.84 | ALDH1A1 (1.00) | ALDH1A1GAAKDM4ESMN1; SMN2LMNA | |
| SCHEMBL5313341 | 0.82 | ALDH1A1 (0.80) | ALDH1A1GAAKDM4ESMN1; SMN2LMNA | |
| SCHEMBL30731686 | 0.81 | ALDH1A1 (0.78) | ALDH1A1GAAKDM4ESMN1; SMN2LMNA | |
| SCHEMBL5314485 | 0.81 | ALDH1A1 (0.78) | ALDH1A1GAAKDM4ESMN1; SMN2LMNA | |
| SCHEMBL5314276 | 0.80 | ALDH1A1 (0.76) | ALDH1A1GAASMN1; SMN2LMNASGMS2 | |
| SCHEMBL5314486 | 0.80 | ALDH1A1 (0.76) | ALDH1A1GAAKDM4ESMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-117466771-A | Green preparation method of alpha-aminonitrile | 山东达因海洋生物制药股份有限公司 | 2024-01-30 | — | — | CN | disclosed |