Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 7/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | PDE4A | P27815 | 2/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8006684 | 0.90 | NPC1 (0.37) | KDM4EL3MBTL1NPC1LMNAMAPT | |
| SCHEMBL312942 | 0.89 | ALDH1A1 (0.35) | KDM4EL3MBTL1NPC1LMNAMAPT | |
| SCHEMBL15216086 | 0.89 | PDE4B (0.35) | KDM4EL3MBTL1NPC1LMNAMAPT | |
| SCHEMBL7996053 | 0.89 | KDM4E (0.36) | KDM4EL3MBTL1NPC1LMNAMAPT | |
| SCHEMBL8005279 | 0.81 | MEN1 (0.36) | KDM4EMEN1KMT2ACYP1A1CYP1B1 | |
| SCHEMBL7996164 | 0.81 | RAB9A (0.37) | KDM4EL3MBTL1NPC1LMNAMAPT | |
| SCHEMBL7994718 | 0.80 | KDM4E (0.40) | KDM4EL3MBTL1NPC1LMNAMAPT | |
| SCHEMBL883446 | 0.80 | MAPT (0.38) | KDM4EL3MBTL1NPC1LMNAMAPT | |
| SCHEMBL577800 | 0.79 | PDE4B (0.36) | KDM4EMAPTRAB9APDE4BMEN1 | |
| SCHEMBL577622 | 0.78 | MEN1 (0.34) | KDM4EL3MBTL1NPC1LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2250174-B1 | MACROCYCLIC SERINE PROTEASE INHIBITORS | IDENIX PHARMACEUTICALS INC (US) | 2013-08-28 | — | — | EP | disclosed |
| WO-2009099596-A2 | MACROCYCLIC SERINE PROTEASE INHIBITORS | IDENIX PHARAMACEUTICALS, INC. (US) | 2009-08-13 | — | — | WO | disclosed |