Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 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 | |
|---|---|---|---|---|
| SCHEMBL7333499 | 0.92 | NOTUM (0.49) | HSP90AA1NOTUMTP53CYP1A2SMN1; SMN2 | |
| SCHEMBL7850892 | 0.75 | CYP1A2 (0.53) | NOTUMTP53CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL8025914 | 0.73 | HSD17B10 (0.57) | NOTUMTP53ALDH1A1HSD17B10KDM4E | |
| SCHEMBL4743709 | 0.73 | BAZ2B (0.56) | NOTUMTP53CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL7843326 | 0.73 | NOTUM (0.47) | NOTUMSMN1; SMN2ALDH1A1HPGDHSD17B10 | |
| SCHEMBL30994678 | 0.71 | HSP90AA1 (0.59) | HSP90AA1TP53CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL642522 | 0.68 | NOTUM (0.63) | NOTUMSMN1; SMN2ALDH1A1HSD17B10KDM4E | |
| SCHEMBL12111806 | 0.68 | HSP90AA1 (0.60) | HSP90AA1TP53CYP1A2SMN1; SMN2ALDH1A1 | |
| SCHEMBL17591343 | 0.67 | NOTUM (0.63) | NOTUMALDH1A1TRIM24 | |
| SCHEMBL11843315 | 0.67 | HSP90AA1 (1.00) | HSP90AA1TP53CYP1A2SMN1; SMN2ALDH1A1 |
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-6048868-A | CIRCADIAN RHYTHM DISORDERS; SLEEP DISORDERS; ANTIDEPRESSANTS | CEMAF (FR) | 2000-04-11 | — | — | US | disclosed |
| EP-0781281-A1 | NOVEL MELATONIN AGONIST $g(b)-CARBOLINE DERIVATIVES AND ANALOGS WITH A NAPHTHALENIC STRUCTURE, METHOD FOR THEIR PREPARATION AND THEIR USE AS DRUGS | CEMAF (FR) | 1997-07-02 | — | — | EP | disclosed |
| WO-1996008490-A1 | NOVEL MELATONIN AGONIST β-CARBOLINE DERIVATIVES AND ANALOGS WITH A NAPHTHALENIC STRUCTURE, METHOD FOR THEIR PREPARATION AND THEIR USE AS DRUGS | CEMAF (FR) | 1996-03-21 | — | — | WO | disclosed |