Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL12835096 | 1.00 | ALDH1A1 (0.62) | ALDH1A1RAB9ASMN1; SMN2NPC1HPGD | |
| SCHEMBL11854131 | 0.84 | TAS2R38 (0.61) | ALDH1A1SMN1; SMN2HPGDKMT2AL3MBTL1 | |
| SCHEMBL29838503 | 0.82 | ALDH1A1 (0.70) | ALDH1A1RAB9ASMN1; SMN2NPC1HPGD | |
| SCHEMBL5449341 | 0.82 | ALDH1A1 (0.70) | ALDH1A1RAB9ASMN1; SMN2NPC1HPGD | |
| SCHEMBL24603642 | 0.80 | ALDH1A1 (0.44) | ALDH1A1RAB9ASMN1; SMN2NPC1HPGD | |
| SCHEMBL1430533 | 0.78 | RAB9A (0.69) | ALDH1A1RAB9ASMN1; SMN2NPC1HPGD | |
| SCHEMBL29408738 | 0.78 | RAB9A (0.69) | ALDH1A1RAB9ASMN1; SMN2NPC1HPGD | |
| SCHEMBL20560546 | 0.78 | RAB9A (0.57) | ALDH1A1RAB9ASMN1; SMN2NPC1HPGD | |
| SCHEMBL29639347 | 0.78 | L3MBTL1 (0.59) | ALDH1A1RAB9ASMN1; SMN2NPC1HPGD | |
| SCHEMBL147200 | 0.78 | L3MBTL1 (0.59) | ALDH1A1RAB9ASMN1; SMN2NPC1HPGD |
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-114956933-A | Marker containing isotope oxygen atom and preparation method and application thereof | 清华大学 | 2022-08-30 | — | — | CN | disclosed |