Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL15343938 | 1.00 | CES2 (0.43) | CES2CES1ALDH1A1NPC1RAB9A | |
| SCHEMBL18503528 | 1.00 | CES2 (0.43) | CES2CES1ALDH1A1NPC1RAB9A | |
| SCHEMBL15343934 | 1.00 | CES2 (0.43) | CES2CES1ALDH1A1NPC1RAB9A | |
| SCHEMBL28854979 | 0.99 | POLB (0.43) | CES2CES1ALDH1A1NPC1RAB9A | |
| SCHEMBL16566138 | 0.99 | POLB (0.43) | CES2CES1ALDH1A1NPC1RAB9A | |
| SCHEMBL16554112 | 0.99 | POLB (0.43) | CES2CES1ALDH1A1NPC1RAB9A | |
| SCHEMBL16554039 | 0.99 | POLB (0.43) | CES2CES1ALDH1A1NPC1RAB9A | |
| SCHEMBL16822791 | 0.99 | POLB (0.43) | CES2CES1ALDH1A1NPC1RAB9A | |
| SCHEMBL16554037 | 0.99 | POLB (0.43) | CES2CES1ALDH1A1NPC1RAB9A | |
| SCHEMBL16554114 | 0.99 | POLB (0.43) | CES2CES1ALDH1A1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-4106877-A1 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2022-12-28 | — | — | EP | disclosed |