Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SYNJ2 | O15056 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PPM1B | O75688 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12724712 | 1.00 | ALDH1A1 (0.46) | ALDH1A1NPC1CES2MAPTSYNJ2 | |
| SCHEMBL1592253 | 1.00 | ALDH1A1 (0.46) | ALDH1A1NPC1CES2MAPTSYNJ2 | |
| SCHEMBL12724709 | 1.00 | ALDH1A1 (0.46) | ALDH1A1NPC1CES2MAPTSYNJ2 | |
| SCHEMBL12724710 | 1.00 | ALDH1A1 (0.46) | ALDH1A1NPC1CES2MAPTSYNJ2 | |
| SCHEMBL1592238 | 1.00 | ALDH1A1 (0.46) | ALDH1A1NPC1CES2MAPTSYNJ2 | |
| SCHEMBL13708353 | 0.88 | ALDH1A1 (0.46) | ALDH1A1NPC1CES2MAPTSYNJ2 | |
| SCHEMBL16131583 | 0.87 | ALDH1A1 (0.46) | ALDH1A1NPC1CES2MAPTSYNJ2 | |
| SCHEMBL12724266 | 0.87 | ALDH1A1 (0.46) | ALDH1A1NPC1CES2MAPTSYNJ2 | |
| SCHEMBL16131584 | 0.87 | ALDH1A1 (0.46) | ALDH1A1NPC1CES2MAPTSYNJ2 | |
| SCHEMBL13708338 | 0.87 | ALDH1A1 (0.46) | ALDH1A1NPC1CES2MAPTSYNJ2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8846636-B2 | Nucleoside analogues with quaternary carbon stereogenic centers and methods of use | LCB PHARMA INC. (CA) | 2014-09-30 | — | — | US | disclosed |