Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.32 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3654750 | 0.94 | ALDH1A1 (0.34) | ALDH1A1TSHRHTTKDM4EIMPDH2 | |
| SCHEMBL16807223 | 0.82 | — | — | |
| SCHEMBL13539590 | 0.80 | KDM4E (0.43) | ALDH1A1TSHRKDM4E | |
| SCHEMBL5595903 | 0.80 | ALDH1A1 (0.31) | ALDH1A1TSHRHTTKDM4E | |
| SCHEMBL15725313 | 0.80 | PGK1 (0.37) | ALDH1A1TSHRHTTKDM4EGAA | |
| SCHEMBL10455200 | 0.76 | TDP1 (0.37) | ALDH1A1TSHRHTTKDM4EGAA | |
| SCHEMBL8432201 | 0.74 | CHEK1 (0.32) | ALDH1A1TSHRHTTKDM4E | |
| SCHEMBL22402745 | 0.74 | ALDH1A1 (0.31) | ALDH1A1TSHRHTTKDM4E | |
| SCHEMBL4008341 | 0.74 | PGK1 (0.46) | ALDH1A1TSHRHTTKDM4EGAA | |
| SCHEMBL9508344 | 0.72 | ACHE (0.37) | ALDH1A1TSHRHTTKDM4EGAA |
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-5049694-A | Cardiovascular disorders | CEDONA PHARMACEUTICALS B.V. (NL) | 1991-09-17 | — | — | US | disclosed |
| EP-0359335-A2 | Pharmaceutical composition having relaxing activity which contains a nitrate ester as active substance | CEDONA PHARMACEUTICALS B.V. (NL) | 1990-03-21 | — | — | EP | disclosed |