Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CCR6 | P51684 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5839890 | 0.86 | ALDH1A1 (0.49) | NPC1RAB9AALDH1A1HTTMAPT | |
| SCHEMBL2911448 | 0.81 | ALDH1A1 (0.51) | NPC1RAB9AALDH1A1HTTMAPT | |
| SCHEMBL2918332 | 0.80 | ALDH1A1 (0.51) | NPC1RAB9AALDH1A1HTTMAPT | |
| SCHEMBL2942288 | 0.77 | ALDH1A1 (0.45) | NPC1RAB9AALDH1A1HTTMAPT | |
| SCHEMBL4363295 | 0.75 | MAPT (0.52) | NPC1RAB9AALDH1A1HTTMAPT | |
| SCHEMBL2910124 | 0.75 | ALDH1A1 (0.47) | NPC1RAB9AALDH1A1HTTMAPT | |
| SCHEMBL4370636 | 0.73 | MAPT (0.49) | NPC1RAB9AALDH1A1HTTMAPT | |
| SCHEMBL4366198 | 0.71 | MAPT (0.53) | NPC1RAB9AALDH1A1MAOBMAPT | |
| SCHEMBL6239637 | 0.71 | POLB (0.58) | NPC1RAB9AALDH1A1HTTMAOB | |
| SCHEMBL4366281 | 0.71 | KMT2A (0.54) | NPC1RAB9AALDH1A1MAOBMAPT |
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-7476686-B2 | Substituted aryl thioureas and related compounds; inhibitors of viral replication | ACHILLION PHARMACEUTICALS, INC. (US) | 2009-01-13 | — | — | US | claimed |