Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 10/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13519757 | 0.83 | EPHX1 (0.46) | EPHX1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL16298724 | 0.83 | EPHX1 (0.46) | EPHX1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL7278921 | 0.81 | SLC15A1 (0.45) | EPHX1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL7609352 | 0.80 | EPHX1 (0.48) | EPHX1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL23541601 | 0.79 | EPHX1 (0.53) | EPHX1ACHEBIRC2 | |
| SCHEMBL7375877 | 0.78 | EPHX1 (0.41) | EPHX1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL12705744 | 0.78 | EPHX1 (0.56) | EPHX1ACHE | |
| SCHEMBL12705745 | 0.78 | EPHX1 (0.56) | EPHX1ACHE | |
| SCHEMBL26361145 | 0.77 | EPHX1 (0.40) | EPHX1NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL14116525 | 0.76 | BIRC2 (0.45) | EPHX1NPC1RAB9ASMN1; SMN2HPGD |
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-2367790-A2 | SUBSTITUTED OCTAHYDROCYCLOPENTA(C)PYRROL-4-AMINES AS CALCIUM CHANNEL BLOCKERS | Abbott Laboratories (US) | 2011-09-28 | — | — | EP | disclosed |