Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.33 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10301436 | 0.77 | NPC1 (0.45) | ALDH1A1NPC1HSD17B10MAPTGFER | |
| SCHEMBL12231891 | 0.76 | NPC1 (0.38) | ALDH1A1NPC1HSD17B10MAPTGFER | |
| SCHEMBL3822427 | 0.76 | ALDH1A1 (0.42) | ALDH1A1NPC1HSD17B10MAPTGFER | |
| SCHEMBL10022977 | 0.75 | NOS1 (0.52) | ALDH1A1NPC1NOS1ADORA2AADORA1 | |
| SCHEMBL3828017 | 0.75 | ALDH1A1 (0.37) | ALDH1A1NPC1HSD17B10MAPTGFER | |
| SCHEMBL13678345 | 0.75 | MAPT (0.37) | ALDH1A1NPC1HSD17B10MAPTGFER | |
| SCHEMBL10329684 | 0.74 | NPC1 (0.42) | ALDH1A1NPC1HSD17B10MAPTGFER | |
| SCHEMBL10329671 | 0.74 | NPC1 (0.42) | ALDH1A1NPC1HSD17B10MAPTGFER | |
| SCHEMBL10329666 | 0.74 | NPC1 (0.42) | ALDH1A1NPC1HSD17B10MAPTGFER | |
| SCHEMBL10091957 | 0.74 | KDM4E (0.61) | ALDH1A1NPC1HSD17B10MAPTADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-9127021-B2 | Hepatitis C virus inhibitors | ENANTA PHARMACEUTICALS, INC. (US) | 2015-09-08 | — | — | US | disclosed |