Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | G6PD | P11413 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 8/20 | 0.34 |
| ▸ | PDE4A | P27815 | 3/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.34 |
| ▸ | PDE11A | Q9HCR9 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL3674311 | 0.89 | PDE4B (0.37) | KDM4EALDH1A1PDE4BPDE4APDE4C | |
| SCHEMBL15216086 | 0.88 | PDE4B (0.35) | KDM4EALDH1A1PDE4BNPC1RAB9A | |
| SCHEMBL7996051 | 0.88 | KMT2A (0.37) | KDM4EALDH1A1PDE4BPDE4APDE4C | |
| SCHEMBL7996053 | 0.88 | KDM4E (0.36) | KDM4EALDH1A1PDE4BPDE4APDE4C | |
| SCHEMBL7996056 | 0.87 | SLC2A1 (0.35) | KDM4EALDH1A1PDE4BPDE11ANPC1 | |
| SCHEMBL313131 | 0.87 | PDE4B (0.36) | ALDH1A1PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL8005137 | 0.84 | KDM4E (0.39) | KDM4EALDH1A1G6PDNPC1RAB9A | |
| SCHEMBL8005821 | 0.81 | ALDH1A1 (0.39) | KDM4EALDH1A1G6PDPDE4BPDE4A | |
| SCHEMBL8006162 | 0.81 | ALDH1A1 (0.37) | KDM4EALDH1A1G6PDNPC1RAB9A | |
| SCHEMBL8008384 | 0.80 | ALDH1A1 (0.36) | KDM4EALDH1A1G6PDNPC1RAB9A |
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 |