Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 14/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6717396 | 0.74 | EPHX2 (0.48) | EPHX2ALDH1A1NPC1RAB9ACNR2 | |
| SCHEMBL8996702 | 0.72 | SIGMAR1 (0.40) | EPHX2ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL6727849 | 0.70 | EPHX2 (0.41) | EPHX2ALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL8996700 | 0.69 | EPHX2 (0.55) | EPHX2LMNAMAPTNPSR1 | |
| SCHEMBL6719597 | 0.69 | CNR2 (0.45) | EPHX2ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL6155754 | 0.68 | SIGMAR1 (0.55) | EPHX2ALDH1A1NPC1RAB9ALMNA | |
| SCHEMBL6158255 | 0.68 | SIGMAR1 (0.53) | EPHX2ALDH1A1RAB9ACNR2MAPT | |
| SCHEMBL6717113 | 0.68 | EPHX2 (0.46) | EPHX2MAPK1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8874234 | 0.67 | SIGMAR1 (0.54) | EPHX2ALDH1A1RAB9ACNR2MAPT | |
| SCHEMBL6154919 | 0.67 | CYP2C19 (0.48) | EPHX2ALDH1A1NPC1RAB9ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5574070-A | Substituted guanidines having high binding to the sigma receptor and the use thereof | STATE OF OREGON, ACTING BY AND THROUGH THE OREGON STATE BOARD OF HIGHER EDUCATION, ACTING FOR AND ON BEHALF OF THE OREGON HEALTH SCIENCES UNIVERSITY (US) | 1996-11-12 | — | — | US | disclosed |