Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | FPR3 | P25089 | 1/20 | 0.34 |
| ▸ | FPR2 | P25090 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7857531 | 0.91 | EPHX2 (0.44) | EPHX2NPC1RAB9AADORA2AADORA1 | |
| SCHEMBL7859105 | 0.87 | EPHX2 (0.43) | EPHX2NPC1RAB9AADORA2AADORA1 | |
| SCHEMBL7859092 | 0.86 | EPHX2 (0.42) | EPHX2NPC1RAB9AADORA2AADORA1 | |
| SCHEMBL7856656 | 0.77 | EPHX2 (0.43) | EPHX2NPC1RAB9AADORA2AADORA1 | |
| SCHEMBL7855762 | 0.76 | EPHX2 (0.43) | EPHX2KMT2ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7856605 | 0.74 | P2RX3 (0.39) | — | |
| SCHEMBL7848736 | 0.73 | EPHX2 (0.41) | EPHX2ROCK2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7857567 | 0.71 | POLB (0.47) | NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL7856575 | 0.71 | EPHX2 (0.39) | EPHX2CYP3A4CYP2C9CYP2C19PDE10A | |
| SCHEMBL13636839 | 0.70 | FPR2 (0.46) | NPC1RAB9AKMT2AFPR2SMN1; SMN2 |
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-2009132453-A1 | CYCLYLAMINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | NEUROMED PHARMACEUTICALS LTD. (CA) | 2009-11-05 | — | — | WO | disclosed |