Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.79 |
| ▸ | HPGD | P15428 | 3/20 | 0.79 |
| ▸ | CDC25B | P30305 | 2/20 | 0.79 |
| ▸ | ATM | Q13315 | 2/20 | 0.79 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.79 |
| ▸ | TP53 | P04637 | 1/20 | 0.79 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.79 |
| ▸ | TSHR | P16473 | 1/20 | 0.79 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.79 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.62 |
| ▸ | MAPT | P10636 | 5/20 | 0.62 |
| ▸ | GAA | P10253 | 5/20 | 0.62 |
| ▸ | MEN1 | O00255 | 5/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | RECQL | P46063 | 2/20 | 0.62 |
| ▸ | GLA | P06280 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | FADS1 | O60427 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29350230 | 0.89 | ALDH1A1 (1.00) | ALDH1A1HPGDCDC25BATMCYP3A4 | |
| SCHEMBL19796 | 0.89 | ALDH1A1 (1.00) | ALDH1A1HPGDCDC25BATMCYP3A4 | |
| SCHEMBL27924058 | 0.87 | ALDH1A1 (0.96) | ALDH1A1HPGDCDC25BATMCYP3A4 | |
| Diphenylamine SCHEMBL1072941 | 0.87 | ALDH1A1 (0.96) | ALDH1A1HPGDCDC25BATMCYP3A4 | |
| Methane SCHEMBL18448188 | 0.87 | ALDH1A1 (0.96) | ALDH1A1HPGDCDC25BATMCYP3A4 | |
| SCHEMBL28286951 | 0.87 | ALDH1A1 (0.96) | ALDH1A1HPGDCDC25BATMCYP3A4 | |
| Hydrogen Sulfide SCHEMBL28156320 | 0.87 | ALDH1A1 (0.96) | ALDH1A1HPGDCDC25BATMCYP3A4 | |
| Hydrochloric Acid SCHEMBL7408656 | 0.87 | ALDH1A1 (0.96) | ALDH1A1HPGDCDC25BATMCYP3A4 | |
| Ammonia Solution, Strong SCHEMBL20918916 | 0.87 | ALDH1A1 (0.96) | ALDH1A1HPGDCDC25BATMCYP3A4 | |
| SCHEMBL4797443 | 0.85 | ALDH1A1 (0.92) | ALDH1A1HPGDCDC25BATMCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1938260-B | Alkylated PANA and DPA compositions | CIBA SC HOLDING AG | 2010-06-16 | — | — | CN | disclosed |
| CN-1938260-A | Alkylated pana and dpa compositions | CIBA SC HOLDING AG (CH) | 2007-03-28 | — | — | CN | disclosed |