Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.43 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.43 |
| ▸ | CHRNG | P07510 | 2/20 | 0.43 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.43 |
| ▸ | CHRND | Q07001 | 2/20 | 0.43 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL30031180 | 0.84 | PARP1 (0.46) | HPGDSLC6A2SLC6A3CHRNA1CHRNG | |
| SCHEMBL21804733 | 0.84 | PARP1 (0.46) | HPGDSLC6A2SLC6A3CHRNA1CHRNG | |
| SCHEMBL28469730 | 0.83 | CES2 (0.45) | SLC6A2SLC6A3CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL28464681 | 0.82 | MEN1 (0.44) | HPGDALOX15SLC6A2SLC6A3CYP2C19 | |
| SCHEMBL28370805 | 0.82 | SMN1; SMN2 (0.45) | HPGDSMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL8021009 | 0.78 | PARP1 (0.53) | HPGDALOX15SLC6A2SLC6A3CHRNA1 | |
| SCHEMBL6057405 | 0.77 | SMN1; SMN2 (0.56) | HPGDALOX15SLC6A2SLC6A3CHRNA1 | |
| SCHEMBL30692281 | 0.77 | SMN1; SMN2 (0.56) | HPGDALOX15SLC6A2SLC6A3CHRNA1 | |
| SCHEMBL14638890 | 0.75 | CA12 (0.36) | HPGDSLC6A2SLC6A3CHRNA1CHRNG | |
| SCHEMBL28470289 | 0.74 | ALDH1A1 (0.41) | HPGDSMN1; SMN2ALDH1A1NPC1RAB9A |
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-111808003-A | Preparation method of thioether | 甘肃农业大学 | 2020-10-23 | — | — | CN | claimed |
| CN-111808003-A | Preparation method of thioether | 甘肃农业大学 | 2020-10-23 | — | — | CN | disclosed |