Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.43 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.43 |
| ▸ | FBP1 | P09467 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.41 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.40 |
| ▸ | APLNR | P35414 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CCR6 | P51684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28439182 | 0.88 | HSP90AA1 (0.50) | HSP90AA1GAAKDM4EALDH1A1HTT | |
| SCHEMBL11282482 | 0.82 | AKR1B1 (0.47) | KDM4EALDH1A1HTTSMN1; SMN2AKR1B1 | |
| SCHEMBL28437060 | 0.80 | PKM (0.49) | HSP90AA1GAAKDM4EALDH1A1HTT | |
| SCHEMBL28440582 | 0.78 | KDM4E (0.57) | HSP90AA1GAAKDM4EALDH1A1HTT | |
| SCHEMBL28442986 | 0.76 | POLB (0.54) | GAAKDM4EALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL28271752 | 0.75 | HTT (0.65) | KDM4EALDH1A1HTTSMN1; SMN2AKR1B1 | |
| SCHEMBL5700502 | 0.72 | KDM4E (0.50) | HSP90AA1GAAKDM4EALDH1A1HTT | |
| SCHEMBL31038187 | 0.71 | CA2 (0.51) | GAAKDM4EALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL811061 | 0.71 | ALDH1A1 (0.76) | GAAKDM4EALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL22330373 | 0.71 | HTR3A (0.45) | KDM4EALDH1A1FBP1HTR3AHRH4 |
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-109096186-B | Synthesis method of 2-arylsulfonyl quinoline derivative | 中南大学 | 2020-08-04 | — | — | CN | disclosed |