Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GRN | P28799 | 1/20 | 0.34 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | LDHA | P00338 | 1/20 | 0.32 |
| ▸ | LDHB | P07195 | 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 | |
|---|---|---|---|---|
| SCHEMBL1930032 | 0.84 | NPSR1 (0.48) | ALDH1A1NPC1TSHRKDM4EMAPT | |
| SCHEMBL17627086 | 0.83 | ALDH1A1 (0.35) | ALDH1A1NPC1HPGDTSHRKDM4E | |
| SCHEMBL18838974 | 0.83 | MCL1 (0.31) | ALDH1A1NPC1HPGDTSHRHCAR2 | |
| SCHEMBL16856775 | 0.83 | HCAR2 (0.36) | ALDH1A1NPC1HPGDTSHRHCAR2 | |
| SCHEMBL936108 | 0.78 | GLA (0.37) | ALDH1A1NPC1TSHRKDM4EPOLB | |
| SCHEMBL3781467 | 0.78 | MEN1 (0.33) | — | |
| SCHEMBL4767678 | 0.75 | KDM4E (0.49) | ALDH1A1HPGDTSHRKDM4EPOLB | |
| SCHEMBL20027815 | 0.72 | ALDH1A1 (0.43) | ALDH1A1HPGDTSHRKDM4EMAPT | |
| SCHEMBL1930028 | 0.70 | NPSR1 (0.56) | ALDH1A1NPC1KDM4EMAPTMAPK1 | |
| SCHEMBL4594309 | 0.67 | ALDH1A1 (0.40) | ALDH1A1NPC1HPGDKDM4EGRN |
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 |
|---|---|---|---|---|---|---|---|
| EP-1539717-B1 | MICROBIOCIDAL (E.G FUNGICIDAL) 1,2,3-TRIAZOLE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2011-07-13 | — | — | EP | disclosed |
| EP-2258690-A1 | Tricyclic amines as intermediates in the synthesis of fungicidal carboxamide derivatives | Syngenta Participations AG (CH) | 2010-12-08 | — | — | EP | disclosed |