Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 3/20 | 0.37 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | RHOA | P61586 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17254707 | 0.91 | NPC1 (0.38) | NPC1RAB9APOLBMAOBMAOA | |
| SCHEMBL29768287 | 0.90 | MAOB (0.45) | NPC1RAB9APOLBMAOBMAOA | |
| SCHEMBL100766 | 0.90 | MAOB (0.45) | NPC1RAB9APOLBMAOBMAOA | |
| SCHEMBL7692453 | 0.87 | NPC1 (0.38) | NPC1RAB9APOLBMAOBMAOA | |
| 1,6-Hexanediol SCHEMBL4254054 | 0.84 | MAOB (0.41) | NPC1RAB9APOLBMAOBMAOA | |
| SCHEMBL13957896 | 0.83 | GAA (0.41) | NPC1RAB9APOLBMAOBMAOA | |
| SCHEMBL466180 | 0.83 | MAOB (0.44) | NPC1RAB9APOLBMAOBMAOA | |
| SCHEMBL7593809 | 0.83 | MAOB (0.45) | POLBMAOBMAOAGAALMNA | |
| SCHEMBL17238263 | 0.82 | NPC1 (0.42) | NPC1RAB9APOLBKEAP1GAA | |
| SCHEMBL8038155 | 0.82 | MAOB (0.43) | NPC1RAB9APOLBMAOBMAOA |
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-5900487-A | ESTER OF 3-(2H-BENZOTRIAZOL-2-TL)-5-(1,1-DIMETHYLETHYL)-4-HYDROXY BENZENEPROPANOIC ACID | GENERAL ELECTRIC COMPANY (US) | 1999-05-04 | — | — | US | disclosed |