Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 3/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.33 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30832181 | 0.80 | HTR2C (0.37) | CYP2C19CYP3A4DDB1CRBN | |
| SCHEMBL30832176 | 0.77 | LMNA (0.38) | SMN1; SMN2ALDH1A1ATMMAPTKMT2A | |
| SCHEMBL30832160 | 0.77 | LMNA (0.38) | SMN1; SMN2ALDH1A1ATMMAPTKMT2A | |
| SCHEMBL30832166 | 0.74 | SMN1; SMN2 (0.36) | CYP2C19SMN1; SMN2DDB1CRBNTSHR | |
| SCHEMBL30832183 | 0.73 | GRM2 (0.39) | CYP2C19ALDH1A1MAPTCYP3A4KMT2A | |
| SCHEMBL28858397 | 0.72 | MAPT (0.38) | SMN1; SMN2ALDH1A1ATMMAPTGAA | |
| SCHEMBL30832186 | 0.71 | GRM2 (0.41) | ALDH1A1CFTRKMT2A | |
| SCHEMBL9281446 | 0.68 | ALDH1A1 (0.47) | SMN1; SMN2ALDH1A1ATMMAPTGAA | |
| SCHEMBL8327879 | 0.65 | SMN1; SMN2 (0.42) | SMN1; SMN2ALDH1A1ATMMAPTGAA | |
| SCHEMBL10726551 | 0.65 | SMN1; SMN2 (0.42) | SMN1; SMN2ALDH1A1ATMMAPTGAA |
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-117865878-A | Chiral indoline-3-one derivative and preparation method thereof | 郑州大学 | 2024-04-12 | — | — | CN | disclosed |