Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29394827 | 0.84 | SMN1; SMN2 (0.49) | NPC1RAB9ASMN1; SMN2POLBCYP1A2 | |
| SCHEMBL76069 | 0.84 | SMN1; SMN2 (0.49) | NPC1RAB9ASMN1; SMN2POLBCYP1A2 | |
| SCHEMBL1186715 | 0.79 | FAAH (0.44) | NPC1RAB9ASMN1; SMN2PDE4APDE4B | |
| Benzotriazole SCHEMBL28307173 | 0.76 | SMN1; SMN2 (0.42) | NPC1RAB9ASMN1; SMN2POLBCYP1A2 | |
| SCHEMBL6254890 | 0.75 | GPR139 (0.39) | NPC1RAB9ASMN1; SMN2POLBMAPT | |
| SCHEMBL22597948 | 0.75 | POLB (0.43) | NPC1RAB9ASMN1; SMN2POLBKMT2A | |
| SCHEMBL17973539 | 0.73 | ALDH1A1 (0.48) | NPC1RAB9ASMN1; SMN2POLBCYP1A2 | |
| SCHEMBL4576394 | 0.72 | ALDH1A1 (0.47) | NPC1RAB9ASMN1; SMN2POLBCYP1A2 | |
| SCHEMBL266156 | 0.71 | TSHR (0.48) | NPC1RAB9ASMN1; SMN2MAPTMEN1 | |
| SCHEMBL17839910 | 0.70 | ALDH1A1 (0.49) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005007634-A1 | 3-HYDROXY-4-OXO-1,2,3-TRIAZINES AND DERIVATIVES THEREOF FOR AMIDE AND ESTER BOND FORMATION | FRUTAROM LTD. (IL) | 2005-01-27 | — | — | WO | claimed |