Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | STS | P08842 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL8945532 | 0.88 | KDM4E (0.40) | ALDH1A1KDM4EALOX5GAAMAPT | |
| SCHEMBL3164161 | 0.70 | CA12 (0.48) | ALDH1A1KDM4EGAAMAPTCA2 | |
| SCHEMBL5838047 | 0.69 | CYP1A2 (0.66) | ALDH1A1KDM4EALOX5GAAMAPT | |
| SCHEMBL11556242 | 0.69 | ALOX15 (0.50) | STSCSNK2A2CSNK2BCSNK2A1ALOX15 | |
| SCHEMBL7796860 | 0.67 | KDM4E (0.55) | ALDH1A1KDM4EGAAMAPTCYP1A2 | |
| SCHEMBL6828193 | 0.67 | PDE2A (0.53) | ALDH1A1KDM4EALOX5GAAMAPT | |
| SCHEMBL4273185 | 0.66 | KDM4E (0.60) | ALDH1A1KDM4EMAPTCYP1A2CYP2D6 | |
| SCHEMBL30843838 | 0.65 | CA12 (0.75) | ALDH1A1KDM4EGAAMAPTBACE1 | |
| SCHEMBL4927952 | 0.65 | CA12 (0.75) | ALDH1A1KDM4EGAAMAPTBACE1 | |
| SCHEMBL5657894 | 0.64 | POLB (0.56) | ALDH1A1KDM4EALOX5GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5510375-A | VIRICIDES TREATING INFECTION CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS AND AIDS | WARNER-LAMBERT COMPANY (US) | 1996-04-23 | — | — | US | disclosed |