Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL26294735 | 1.00 | NPC1 (0.45) | NPC1RAB9APOLBCES2CES1 | |
| SCHEMBL16822791 | 0.97 | POLB (0.43) | NPC1RAB9APOLBCES2CES1 | |
| SCHEMBL28854979 | 0.97 | POLB (0.43) | NPC1RAB9APOLBCES2CES1 | |
| SCHEMBL26276587 | 0.97 | POLB (0.43) | NPC1RAB9APOLBCES2CES1 | |
| SCHEMBL16554112 | 0.97 | POLB (0.43) | NPC1RAB9APOLBCES2CES1 | |
| SCHEMBL16554037 | 0.97 | POLB (0.43) | NPC1RAB9APOLBCES2CES1 | |
| SCHEMBL16554039 | 0.97 | POLB (0.43) | NPC1RAB9APOLBCES2CES1 | |
| SCHEMBL16554114 | 0.97 | POLB (0.43) | NPC1RAB9APOLBCES2CES1 | |
| SCHEMBL16566138 | 0.97 | POLB (0.43) | NPC1RAB9APOLBCES2CES1 | |
| SCHEMBL30160662 | 0.96 | CES2 (0.43) | NPC1RAB9APOLBCES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115175735-A | Antiviral compounds | 吉利德科学公司 | 2022-10-11 | — | — | CN | disclosed |