Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.53 |
| ▸ | NPC1 | O15118 | 5/20 | 0.53 |
| ▸ | RAB9A | P51151 | 5/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.53 |
| ▸ | RELA | Q04206 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | STAT1 | P42224 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL21056853 | 0.88 | ALDH1A1 (0.54) | SMN1; SMN2NPC1RAB9AMAPTNFKB1 | |
| SCHEMBL8217561 | 0.88 | CASP1 (0.48) | SMN1; SMN2NPC1RAB9AMAPTTSHR | |
| SCHEMBL28109624 | 0.86 | MAPK14 (0.56) | SMN1; SMN2NPC1RAB9AMAPTTSHR | |
| SCHEMBL31470920 | 0.86 | MAPK14 (0.56) | SMN1; SMN2NPC1RAB9AMAPTTSHR | |
| SCHEMBL9260863 | 0.85 | ALDH1A1 (0.56) | SMN1; SMN2NPC1RAB9AMAPTNFKB1 | |
| Isoquinoline SCHEMBL28038089 | 0.84 | SCN1A (0.50) | SMN1; SMN2NPC1RAB9AMAPTNFKB1 | |
| SCHEMBL8223362 | 0.83 | ALDH1A1 (0.48) | SMN1; SMN2NPC1RAB9AMAPTTSHR | |
| SCHEMBL6927417 | 0.83 | FGFR1 (0.58) | ALDH1A1MAPK1LMNAATMKDM4E | |
| SCHEMBL3517715 | 0.82 | RAB9A (0.59) | SMN1; SMN2NPC1RAB9AMAPTNFKB1 | |
| SCHEMBL7642688 | 0.82 | TSHR (0.61) | MAPTTSHRALDH1A1MAPK1HPGD |
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-109790146-A | Medical compounds | 阿尔麦克探索有限公司 | 2019-05-21 | — | — | CN | disclosed |