Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 5/20 | 0.50 |
| ▸ | RAB9A | P51151 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.49 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.48 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4593089 | 0.78 | POLB (0.56) | POLBSMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL12437777 | 0.74 | NPC1 (0.79) | HPGDPOLBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL29531380 | 0.74 | NPC1 (0.79) | HPGDPOLBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL31497712 | 0.74 | NPC1 (0.56) | HPGDPOLBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL2892473 | 0.73 | ALDH1A1 (0.43) | HPGDPOLBALDH1A1GAA | |
| SCHEMBL28438775 | 0.72 | GRM5 (0.64) | HPGDPOLBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL4748938 | 0.72 | CYP1A2 (0.58) | HPGDPOLBNPC1RAB9AALDH1A1 | |
| SCHEMBL1249452 | 0.71 | — | — | |
| SCHEMBL9055150 | 0.71 | HPGD (0.89) | HPGDPOLBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL561358 | 0.71 | ALDH1A1 (0.46) | ALDH1A1KMT2AGAAMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117794896-A | Protease inhibitors for the treatment of coronavirus infections | 斯克里普斯研究学院 | 2024-03-29 | — | — | CN | claimed |
| CN-117794896-A | Protease inhibitors for the treatment of coronavirus infections | 斯克里普斯研究学院 | 2024-03-29 | — | — | CN | disclosed |