Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.63 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MYC | P01106 | 3/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL1715918 | 0.93 | NPC1 (0.71) | NPC1PTPN1L3MBTL1GAAALDH1A1 | |
| SCHEMBL227731 | 0.93 | NPC1 (0.71) | NPC1PTPN1L3MBTL1GAAALDH1A1 | |
| SCHEMBL29467270 | 0.91 | NPC1 (0.68) | NPC1PTPN1L3MBTL1GAAALDH1A1 | |
| SCHEMBL2492855 | 0.91 | NPC1 (0.68) | NPC1PTPN1L3MBTL1GAAALDH1A1 | |
| SCHEMBL8048603 | 0.84 | ALDH1A1 (0.61) | NPC1PTPN1L3MBTL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL10607126 | 0.83 | NPC1 (0.62) | NPC1PTPN1L3MBTL1GAAALDH1A1 | |
| SCHEMBL28086833 | 0.78 | NPC1 (0.70) | NPC1PTPN1L3MBTL1GAAALDH1A1 | |
| SCHEMBL10684744 | 0.78 | NPC1 (0.65) | NPC1PTPN1L3MBTL1GAAALDH1A1 | |
| SCHEMBL3808106 | 0.77 | ALDH1A1 (0.70) | NPC1ALDH1A1SMN1; SMN2POLBALOX15 | |
| SCHEMBL605593 | 0.77 | NPC1 (1.00) | NPC1PTPN1L3MBTL1GAAALDH1A1 |
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-114671818-A | Compound and derivatizing reagent, and method for synthesizing compound | 学校法人东京理科大学 | 2022-06-28 | — | — | CN | disclosed |