Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 1/20 | 0.42 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CDYL2 | Q8N8U2 | 1/20 | 0.39 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.39 |
| ▸ | TGM2 | P21980 | 1/20 | 0.38 |
| ▸ | HTR5A | P47898 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL5431073 | 0.79 | CDYL2 (0.43) | TP53ALDH1A1GAASMN1; SMN2CDYL2 | |
| SCHEMBL29242299 | 0.79 | TP53 (0.46) | TP53SMN1; SMN2CDYL2CDYL | |
| SCHEMBL29242339 | 0.74 | PBRM1 (0.53) | PBRM1ALDH1A1HTR5AHTR1AHTR1D | |
| SCHEMBL4590075 | 0.74 | HTR1A (0.48) | TP53ALDH1A1GAASMN1; SMN2HTR5A | |
| SCHEMBL29242312 | 0.70 | PBRM1 (0.45) | PBRM1TP53ALDH1A1HTTHTR5A | |
| SCHEMBL29242316 | 0.70 | PBRM1 (0.49) | PBRM1ALDH1A1HTTSMN1; SMN2HTR5A | |
| SCHEMBL24112229 | 0.69 | HTR5A (0.51) | PBRM1TP53GAAHTR5AHTR1A | |
| SCHEMBL24112728 | 0.69 | HTR5A (0.51) | PBRM1TP53GAAHTR5AHTR1A | |
| SCHEMBL24029073 | 0.69 | HTR5A (0.47) | PBRM1TP53ALDH1A1GAAHTT | |
| SCHEMBL13431421 | 0.69 | BRD4 (0.51) | TP53ALDH1A1HTTSMN1; SMN2MAOA |
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-118221565-A | 3-Aryl indol-2-one compound with anticancer activity and application thereof in preparation of medicines for treating cancers | 常州大学 | 2024-06-21 | — | — | CN | disclosed |