Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | IGF1R | P08069 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | PGK1 | P00558 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8006158 | 0.88 | IGF1R (0.35) | IGF1RNPC1HSP90AA1HSP90AB1PDE3B | |
| SCHEMBL15216079 | 0.82 | SLC2A1 (0.40) | SLC2A1GAANPC1KDM4EALDH1A1 | |
| SCHEMBL7993018 | 0.81 | SLC2A1 (0.41) | SLC2A1GAANPC1HSP90AA1HSP90AB1 | |
| SCHEMBL8003565 | 0.80 | KDM4E (0.41) | SLC2A1NPC1KDM4EALDH1A1KDR | |
| SCHEMBL8003756 | 0.79 | KDM4E (0.36) | NPC1KDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL577664 | 0.78 | IGF1R (0.33) | IGF1RPGK1GSK3BMAP4K2MAPT | |
| SCHEMBL8005879 | 0.76 | KDM4E (0.42) | GAANPC1KDM4EALDH1A1PDE3B | |
| SCHEMBL15216086 | 0.76 | PDE4B (0.35) | NPC1KDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL7996051 | 0.76 | KMT2A (0.37) | NPC1KDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL7996056 | 0.75 | SLC2A1 (0.35) | SLC2A1NPC1KDM4EALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009099596-A2 | MACROCYCLIC SERINE PROTEASE INHIBITORS | IDENIX PHARAMACEUTICALS, INC. (US) | 2009-08-13 | — | — | WO | disclosed |