Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.34 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | PGK1 | P00558 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.34 |
| ▸ | DCK | P27707 | 9/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.33 |
| ▸ | EPHA2 | P29317 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15216173 | 0.88 | ALDH1A1 (0.36) | ALDH1A1KDM4ETDP1GAALMNA | |
| SCHEMBL8005887 | 0.82 | SLC2A1 (0.40) | SLC2A1ALDH1A1KDM4ETDP1GAA | |
| SCHEMBL7993018 | 0.81 | SLC2A1 (0.41) | SLC2A1ALDH1A1KDM4ETDP1GAA | |
| SCHEMBL15216090 | 0.76 | ALDH1A1 (0.41) | SLC2A1ALDH1A1KDM4ETDP1GAA | |
| SCHEMBL15216080 | 0.76 | ALDH1A1 (0.40) | ALDH1A1KDM4ETDP1GAANPC1 | |
| SCHEMBL15216087 | 0.73 | SLC2A1 (0.42) | SLC2A1ALDH1A1KDM4ETDP1GAA | |
| SCHEMBL8006158 | 0.70 | IGF1R (0.35) | NPC1MAPTPGK1GSK3BMAP4K2 | |
| SCHEMBL314417 | 0.67 | PDE3B (0.33) | ALDH1A1GAANPC1MAPTGFER | |
| SCHEMBL7995961 | 0.67 | SLC2A1 (0.43) | SLC2A1ALDH1A1KDM4ETDP1GAA | |
| SCHEMBL8003339 | 0.63 | POLB (0.39) | ALDH1A1KDM4EGAALMNAMAPT |
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-2250174-B1 | MACROCYCLIC SERINE PROTEASE INHIBITORS | IDENIX PHARMACEUTICALS INC (US) | 2013-08-28 | — | — | EP | disclosed |