Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.38 |
| ▸ | ITGAV | P06756 | 1/20 | 0.38 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27560200 | 0.94 | TLR2 (0.43) | EPHX1HPGDBCHESIGMAR1EPHX2 | |
| SCHEMBL21362848 | 0.79 | HPGD (0.48) | EPHX1HPGDEPHX2ITGB3ITGB1 | |
| SCHEMBL23023176 | 0.75 | EPHX2 (0.50) | EPHX1HPGDSIGMAR1EPHX2ITGB3 | |
| SCHEMBL8907879 | 0.75 | EPHX2 (0.50) | EPHX1HPGDSIGMAR1EPHX2ITGB3 | |
| SCHEMBL18886611 | 0.75 | EPHX1 (0.49) | EPHX1HPGDSIGMAR1EPHX2ITGB3 | |
| SCHEMBL23004863 | 0.75 | NPC1 (0.47) | EPHX1HPGDSIGMAR1EPHX2ALDH1A1 | |
| SCHEMBL27262559 | 0.75 | BCHE (0.43) | HPGDBCHEEPHX2PKMCTDSP1 | |
| SCHEMBL23022872 | 0.74 | SIGMAR1 (0.47) | EPHX1HPGDSIGMAR1EPHX2ITGB3 | |
| SCHEMBL27308031 | 0.74 | HPGD (0.45) | EPHX1HPGDSIGMAR1ALDH1A1RAB9A | |
| SCHEMBL9390747 | 0.73 | SIGMAR1 (0.50) | EPHX1HPGDSIGMAR1EPHX2ITGB3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6057371-A | TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, DRUG ABUSE, ANGINA, MIGRAINE, HYPERTENSION AND DEPRESSION | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 2000-05-02 | — | — | US | disclosed |
| EP-0591426-A1 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1994-04-13 | — | — | EP | disclosed |
| WO-1993000313-A2 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1993-01-07 | — | — | WO | disclosed |