Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30900480 | 0.74 | NUDT1 (0.39) | PHGDHNUDT1 | |
| SCHEMBL11733576 | 0.73 | MEN1 (0.48) | ALDH1A1MAPTKDM4EALOX5HTR3E | |
| SCHEMBL432973 | 0.72 | ALOX5 (0.55) | ALDH1A1MAPTKDM4EALOX5PTGS1 | |
| SCHEMBL2479231 | 0.71 | ALDH1A1 (0.51) | ALDH1A1MAPTKDM4EALOX5PTGS1 | |
| SCHEMBL11728248 | 0.70 | DRD3 (0.43) | ALDH1A1MAPTKDM4EDRD2DRD3 | |
| SCHEMBL11729992 | 0.70 | PIK3CA (0.50) | ALDH1A1DRD2DRD3KCNH2HTT | |
| SCHEMBL10539432 | 0.69 | ALDH1A1 (0.79) | ALDH1A1MAPTKDM4EALOX5PTGS1 | |
| SCHEMBL18003260 | 0.68 | ALDH1A1 (0.51) | ALDH1A1MAPTKDM4EALOX5PTGS1 | |
| SCHEMBL11732890 | 0.68 | DRD2 (0.43) | ALDH1A1DRD2DRD3KCNH2HTT | |
| SCHEMBL15766789 | 0.68 | DDB1 (0.64) | ALDH1A1MAPTKDM4EALOX5PTGS1 |
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-102725291-B | Bicyclic pyridine and relevant analog as Sirtuin regulator | 西特里斯药业公司 | 2016-12-21 | — | — | CN | disclosed |