Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | CDC7 | O00311 | 1/20 | 0.48 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | MET | P08581 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6640173 | 0.81 | CTSB (0.54) | CTSBALDH1A1MAPTHTTL3MBTL1 | |
| SCHEMBL7509985 | 0.77 | HSD17B10 (0.65) | CTSBALDH1A1MAPTHTTL3MBTL1 | |
| SCHEMBL6638341 | 0.74 | MAPK1 (0.47) | ALDH1A1MAPTHTTL3MBTL1LMNA | |
| SCHEMBL3244533 | 0.72 | TSHR (0.65) | CTSBALDH1A1MAPTHTTL3MBTL1 | |
| SCHEMBL3240297 | 0.72 | TSHR (0.65) | CTSBALDH1A1MAPTHTTL3MBTL1 | |
| SCHEMBL13722496 | 0.72 | MEN1 (0.60) | CTSBALDH1A1MAPTHTTL3MBTL1 | |
| SCHEMBL27682796 | 0.71 | CYP1A2 (0.57) | ALDH1A1MAPTHPGDLMNATSHR | |
| SCHEMBL6637689 | 0.71 | CTSB (0.54) | CTSBALDH1A1MAPTHTTL3MBTL1 | |
| SCHEMBL5657175 | 0.70 | MAPT (0.61) | CTSBALDH1A1MAPTHTTLMNA | |
| SCHEMBL10480613 | 0.70 | MAPT (0.56) | CTSBALDH1A1MAPTHTTL3MBTL1 |
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-102250097-A | 6-alkyloxy-2-alkylthio-8-azapurine and synthesis thereof | UNIV BEIJING CHEMICAL | 2011-11-23 | — | — | CN | disclosed |