Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 4/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL23526300 | 0.85 | MAOB (0.47) | NPSR1POLBACHEACSS2ALDH1A1 | |
| SCHEMBL13199189 | 0.84 | ACSS2 (0.51) | NPSR1POLBACHEACSS2ALDH1A1 | |
| SCHEMBL12185167 | 0.81 | NPSR1 (0.46) | NPSR1POLBACSS2ALDH1A1MAPT | |
| SCHEMBL30358161 | 0.80 | ACSS2 (0.46) | NPSR1POLBACSS2ALDH1A1MAPT | |
| SCHEMBL1657919 | 0.80 | ACSS2 (0.46) | NPSR1POLBACSS2ALDH1A1MAPT | |
| SCHEMBL30628323 | 0.80 | ACSS2 (0.48) | NPSR1POLBACHEACSS2CES2 | |
| SCHEMBL31306494 | 0.80 | NPSR1 (0.50) | NPSR1POLBACSS2ALDH1A1CES2 | |
| SCHEMBL2012390 | 0.80 | ACSS2 (0.48) | NPSR1POLBACHEACSS2CES2 | |
| SCHEMBL17420423 | 0.79 | POLB (0.51) | NPSR1POLBACSS2ALDH1A1MAPT | |
| SCHEMBL17420520 | 0.79 | ACSS2 (0.47) | NPSR1POLBACSS2ALDH1A1MAPT |
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-113727758-A | Bicyclic heterocyclic compounds and use thereof | 锐新医药公司 | 2021-11-30 | — | — | CN | disclosed |