Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | SLC40A1 | Q9NP59 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| SCHEMBL6465290 | 0.87 | CYP3A4 (0.46) | SMN1; SMN2ALDH1A1MAPK1KMT2ARAB9A | |
| SCHEMBL7049145 | 0.78 | KCNA5 (0.38) | HPGDALOX15TDP1SLC40A1SMN1; SMN2 | |
| SCHEMBL6466215 | 0.73 | SMN1; SMN2 (0.42) | HPGDALOX15TDP1SLC40A1SMN1; SMN2 | |
| SCHEMBL4067173 | 0.66 | HPGD (1.00) | HPGDALOX15TDP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL12125320 | 0.64 | SMN1; SMN2 (0.80) | HPGDALOX15TDP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL18781735 | 0.64 | SLC40A1 (0.62) | HPGDSLC40A1SMN1; SMN2ALDH1A1MAPK1 | |
| Hydrochloric Acid SCHEMBL29505709 | 0.63 | SLC40A1 (0.62) | HPGDSLC40A1SMN1; SMN2ALDH1A1MAPK1 | |
| Hydrochloric Acid SCHEMBL18765428 | 0.63 | SLC40A1 (0.62) | HPGDSLC40A1SMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL2840152 | 0.63 | SMN1; SMN2 (0.56) | HPGDALOX15TDP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL1171725 | 0.63 | EPHX2 (0.68) | HPGDALOX15TDP1SMN1; SMN2ALDH1A1 |
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-1516877-A1 | Amine derivatives as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2005-03-23 | — | — | EP | disclosed |