Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CFTR | P13569 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL6152278 | 0.87 | ALDH1A1 (0.45) | ALDH1A1NPC1RAB9AL3MBTL1POLB | |
| SCHEMBL6152031 | 0.86 | OPRM1 (0.32) | — | |
| SCHEMBL6582104 | 0.84 | IDO1 (0.34) | ALDH1A1HTTMAPTMEN1KMT2A | |
| SCHEMBL6585426 | 0.84 | HPGDS (0.33) | ALDH1A1RAB9AMAPTHSD17B10LMNA | |
| SCHEMBL6153084 | 0.83 | CYP2C9 (0.36) | ALDH1A1HTTCYP2C9CFTRMAPT | |
| SCHEMBL6581680 | 0.79 | ALDH1A1 (0.36) | ALDH1A1HTTL3MBTL1POLBMAPT | |
| SCHEMBL6152990 | 0.78 | NPC1 (0.33) | ALDH1A1NPC1RAB9AHTTCYP2C9 | |
| SCHEMBL6295391 | 0.75 | CYP2C9 (0.34) | ALDH1A1HTTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6581698 | 0.74 | ALDH1A1 (0.32) | ALDH1A1RAB9AHTTCYP1A2CYP3A4 | |
| SCHEMBL6152459 | 0.74 | NPC1 (0.49) | ALDH1A1NPC1RAB9AHTTCYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1406610-B1 | USE OF SUBSTITUTED GAMMA-LACTONE COMPOUNDS AS MEDICAMENTS | GRUENENTHAL GMBH (DE) | 2005-01-26 | — | — | EP | claimed |
| EP-1406610-B1 | USE OF SUBSTITUTED GAMMA-LACTONE COMPOUNDS AS MEDICAMENTS | GRUENENTHAL GMBH (DE) | 2005-01-26 | — | — | EP | disclosed |