Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HNF4A | P41235 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2097892 | 0.84 | HNF4A (0.43) | ALDH1A1HNF4ANPC1POLBALOX15 | |
| SCHEMBL27962544 | 0.83 | ALOX15 (0.38) | ALDH1A1TDP1POLBALOX15ALOX12 | |
| SCHEMBL28258098 | 0.82 | PPARG (0.40) | ALDH1A1MAPK1TDP1SMN1; SMN2KDM4E | |
| SCHEMBL28080958 | 0.80 | NR4A2 (0.42) | ALDH1A1MAPK1NPC1POLBALOX12 | |
| SCHEMBL27962545 | 0.79 | HDAC8 (0.44) | HDAC4HDAC2HDAC8HDAC6 | |
| SCHEMBL3977063 | 0.77 | LMNA (0.45) | ALDH1A1TDP1SMN1; SMN2RAB9ANPSR1 | |
| SCHEMBL3977739 | 0.77 | GAA (0.43) | ALDH1A1KDM4ERAB9AMEN1MAPT | |
| SCHEMBL27624327 | 0.76 | ACVR1 (0.43) | ALDH1A1NPC1SMN1; SMN2RAB9AMAPT | |
| SCHEMBL3977617 | 0.73 | MAPT (0.37) | ALDH1A1NPC1POLBALOX15ALOX12 | |
| SCHEMBL3977724 | 0.72 | NPC1 (0.50) | ALDH1A1NPC1SMN1; SMN2RAB9AMEN1 |
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-103804108-B | A kind of method preparing primary amine | 沈阳药科大学 | 2016-08-03 | — | — | CN | disclosed |