Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.43 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 7/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3639699 | 0.83 | ALDH1A1 (0.50) | ALDH1A1PKMLMNAGAATP53 | |
| SCHEMBL3639695 | 0.83 | ALDH1A1 (0.50) | ALDH1A1PKMLMNAGAATP53 | |
| SCHEMBL2205094 | 0.81 | PKM (0.51) | ALDH1A1PKMLMNAGAATP53 | |
| SCHEMBL16029880 | 0.78 | ALDH1A1 (0.48) | ALDH1A1PKMLMNAGAATP53 | |
| SCHEMBL10656431 | 0.77 | ALDH1A1 (0.47) | ALDH1A1PKMLMNAGAATP53 | |
| SCHEMBL10494866 | 0.77 | ALDH1A1 (0.47) | ALDH1A1PKMLMNAGAATP53 | |
| SCHEMBL6328714 | 0.76 | POLB (0.51) | ALDH1A1PKMLMNAGAATP53 | |
| SCHEMBL6478977 | 0.76 | POLB (0.51) | ALDH1A1PKMLMNAGAATP53 | |
| SCHEMBL10494884 | 0.76 | MAPT (0.53) | ALDH1A1PKMGAASMN1; SMN2TDP1 | |
| SCHEMBL7611507 | 0.76 | ALDH1A1 (0.61) | ALDH1A1PKMLMNAGAATP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0045964-A1 | Derivatives of 3-amino-1,2-propane diol | CIBA-GEIGY AG (CH) | 1982-02-17 | — | — | EP | disclosed |