Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.58 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.57 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL22813680 | 0.90 | SIGMAR1 (0.62) | SIGMAR1HRH3HPGDSMN1; SMN2NPC1 | |
| SCHEMBL8097185 | 0.84 | SMN1; SMN2 (0.64) | SIGMAR1TRPV1HPGDSMN1; SMN2RAB9A | |
| SCHEMBL8091251 | 0.83 | SIGMAR1 (0.54) | HDAC1HDAC6SIGMAR1NPC1RAB9A | |
| SCHEMBL8084480 | 0.81 | NAAA (0.62) | TRPV1HPGDNPC1RAB9A | |
| SCHEMBL31329313 | 0.80 | HPGD (0.66) | SIGMAR1HPGDSMN1; SMN2RAB9ACYP2D6 | |
| SCHEMBL31329285 | 0.80 | HPGD (0.66) | SIGMAR1HPGDSMN1; SMN2RAB9ACYP2D6 | |
| SCHEMBL7376148 | 0.80 | NPC1 (0.76) | TRPV1HPGDSMN1; SMN2NPC1RAB9A | |
| SCHEMBL8326447 | 0.80 | SIGMAR1 (0.66) | SIGMAR1HRH3 | |
| SCHEMBL2835539 | 0.79 | KMT2A (0.60) | SIGMAR1HRH3NPC1CYP2D6 | |
| SCHEMBL31329280 | 0.79 | FKBP1A (0.64) | SIGMAR1HPGDSMN1; SMN2CYP2D6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0591426-A1 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1994-04-13 | — | — | EP | claimed |
| WO-1993000313-A2 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1993-01-07 | — | — | WO | claimed |
| 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 |