Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.48 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.48 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | NAMPT | P43490 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19986699 | 0.88 | LMNA (0.53) | KMT2AMEN1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL19986554 | 0.81 | MEN1 (0.47) | KMT2AMEN1ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL19986564 | 0.81 | NAMPT (0.52) | KMT2AMEN1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL19986446 | 0.81 | KMT2A (0.49) | KMT2AMEN1ALDH1A1NPC1RAB9A | |
| SCHEMBL19986507 | 0.79 | KMT2A (0.38) | KMT2AMEN1ALDH1A1MAPTNAMPT | |
| SCHEMBL28807983 | 0.78 | HSD17B10 (0.65) | KMT2AMEN1ALDH1A1SMN1; SMN2PKM | |
| SCHEMBL10192064 | 0.77 | MAPT (0.72) | KMT2AMEN1ALDH1A1SMN1; SMN2PKM | |
| SCHEMBL2058714 | 0.76 | KMT2A (0.63) | KMT2AMEN1ALDH1A1SMN1; SMN2PKM | |
| SCHEMBL3781565 | 0.76 | ALDH1A1 (0.67) | KMT2AMEN1ALDH1A1SMN1; SMN2PKM | |
| SCHEMBL19986718 | 0.75 | ALDH1A1 (0.42) | KMT2AMEN1ALDH1A1SMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018050110-A1 | NOVEL CAPSID PROTEIN ASSEMBLY INHIBITOR | 正大天晴药业集团股份有限公司 | 2018-03-22 | — | — | WO | disclosed |