Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 2/20 | 0.35 |
| ▸ | IMPDH2 | P12268 | 3/20 | 0.34 |
| ▸ | IMPDH1 | P20839 | 2/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.33 |
| ▸ | ANPEP | P15144 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20690651 | 0.81 | AR (0.42) | CA1CA2ALDH1A1KDM4EMAPT | |
| SCHEMBL12310191 | 0.79 | AR (0.41) | CA1CA2ALDH1A1KDM4EMAPT | |
| SCHEMBL3026903 | 0.77 | CA1 (0.41) | CA1CA2ALDH1A1KDM4EMAPT | |
| SCHEMBL27829855 | 0.77 | DYRK1A (0.47) | CA1CA2ALDH1A1KDM4EMAPT | |
| SCHEMBL5250990 | 0.77 | ALDH1A1 (0.41) | CA1CA2ALDH1A1KDM4EMAPT | |
| SCHEMBL5250992 | 0.77 | CYP1A2 (0.50) | CA1CA2ALDH1A1KDM4EMAPT | |
| SCHEMBL4228106 | 0.75 | IMPDH2 (0.52) | CA1CA2ALDH1A1KDM4EMAPT | |
| SCHEMBL7300758 | 0.74 | PGR (0.31) | ALDH1A1KDM4EMAPTGAAAR | |
| SCHEMBL7635310 | 0.74 | TDP1 (0.58) | ALDH1A1GAAMEN1KMT2AAR | |
| SCHEMBL28241231 | 0.73 | ANPEP (0.56) | CA1CA2ALDH1A1KDM4EMAPT |
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-5629406-A | AMINO ACID DERIVATIVES | SANKYO COMPANY, LIMITED (JP) | 1997-05-13 | — | — | US | disclosed |
| EP-0587311-A1 | Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use | SANKYO COMPANY LIMITED (JP) | 1994-03-16 | — | — | EP | disclosed |