Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.68 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | DRD2 | P14416 | 3/20 | 0.62 |
| ▸ | DRD4 | P21917 | 3/20 | 0.62 |
| ▸ | DRD3 | P35462 | 3/20 | 0.62 |
| ▸ | ATM | Q13315 | 1/20 | 0.59 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | LTA4H | P09960 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | BCHE | P06276 | 1/20 | 0.58 |
| ▸ | HTR2A | P28223 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL3621768 | 0.97 | SIGMAR1 (0.70) | SIGMAR1MEN1KMT2ADRD2DRD4 | |
| SCHEMBL6552032 | 0.92 | MEN1 (0.71) | SIGMAR1MEN1KMT2AATMCHRM2 | |
| SCHEMBL9520509 | 0.92 | MEN1 (0.71) | SIGMAR1MEN1KMT2AATMCHRM2 | |
| SCHEMBL9372179 | 0.90 | SIGMAR1 (0.72) | SIGMAR1MEN1KMT2AATMCHRM2 | |
| SCHEMBL4614753 | 0.89 | MEN1 (0.71) | MEN1KMT2AATMALDH1A1SMN1; SMN2 | |
| SCHEMBL5632470 | 0.87 | LTA4H (0.69) | SIGMAR1ALDH1A1LTA4HTDP1L3MBTL1 | |
| SCHEMBL275640 | 0.86 | CHRM2 (0.59) | SIGMAR1MEN1KMT2ACHRM2ALDH1A1 | |
| SCHEMBL5966301 | 0.85 | TDP1 (0.75) | SIGMAR1ALDH1A1LTA4HTDP1L3MBTL1 | |
| SCHEMBL12040566 | 0.85 | TDP1 (0.75) | SIGMAR1ALDH1A1LTA4HTDP1L3MBTL1 | |
| SCHEMBL6835324 | 0.84 | CHRM2 (0.56) | SIGMAR1CHRM2SMN1; 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 4 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 |
| WO-1991009594-A1 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1991-07-11 | — | — | WO | disclosed |