Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.59 |
| ▸ | MAPT | P10636 | 5/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.53 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.53 |
| ▸ | PFKFB1 | P16118 | 1/20 | 0.50 |
| ▸ | UBE2N | P61088 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27572255 | 0.88 | MAPT (0.46) | ALDH1A1MAPTKDM4EALOX15HSD17B10 | |
| SCHEMBL935141 | 0.75 | ALDH1A1 (1.00) | ALDH1A1MAPTKDM4EALOX15HSD17B10 | |
| SCHEMBL3064294 | 0.75 | MAPT (0.67) | ALDH1A1MAPTKDM4EALOX15HSD17B10 | |
| SCHEMBL7013023 | 0.73 | ADORA3 (0.65) | ALDH1A1MAPTKDM4EALOX15HSD17B10 | |
| SCHEMBL19720089 | 0.73 | PFKFB1 (0.50) | ALDH1A1MAPTKDM4EADORA3ADORA2A | |
| SCHEMBL4306407 | 0.72 | ADORA3 (0.64) | ALDH1A1MAPTKDM4EALOX15HSD17B10 | |
| SCHEMBL23885077 | 0.70 | PFKFB1 (0.76) | ALDH1A1KDM4EALOX15HSD17B10PFKFB1 | |
| SCHEMBL30052633 | 0.70 | PFKFB1 (0.76) | ALDH1A1KDM4EALOX15HSD17B10PFKFB1 | |
| SCHEMBL8472800 | 0.69 | SMN1; SMN2 (0.50) | ALDH1A1MAPTKDM4EADORA3ADORA2A | |
| SCHEMBL1778210 | 0.69 | KDM4E (0.58) | ALDH1A1MAPTKDM4EALOX15HSD17B10 |
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-1407971-A | Substituted 2-thio-3,5-dicyano-4-aryl-6-aminopyridines and the use thereof | BAYER AG (DE) | 2003-04-02 | — | — | CN | disclosed |