Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30250036 | 1.00 | SLC6A2 (0.35) | SLC6A2SLC6A4SLC6A3PTGS2ALOX12 | |
| Padoprazan SCHEMBL25225599 | 0.91 | AVPR2 (0.39) | PTGS2PTGS1HTR6SMN1; SMN2ATM | |
| Padoprazan SCHEMBL30250197 | 0.91 | AVPR2 (0.39) | PTGS2PTGS1HTR6SMN1; SMN2ATM | |
| SCHEMBL30250179 | 0.89 | SLC6A4 (0.37) | SLC6A2SLC6A4SLC6A3PTGS2ALOX12 | |
| SCHEMBL25314470 | 0.89 | SLC6A4 (0.37) | SLC6A2SLC6A4SLC6A3PTGS2ALOX12 | |
| Padoprazan SCHEMBL30985953 | 0.84 | AVPR2 (0.36) | HTR6MEN1KMT2A | |
| SCHEMBL28996381 | 0.83 | PTGS2 (0.35) | PTGS2PTGS1SMN1; SMN2LMNAATM | |
| SCHEMBL29241023 | 0.82 | KAT6A (0.34) | PTGS2PTGS1ALDH1A1MDM2HTR6 | |
| SCHEMBL30427353 | 0.81 | CHRNB4 (0.37) | ALDH1A1HTR6HTTKMT2A | |
| SCHEMBL18196881 | 0.81 | MAPK1 (0.44) | ALDH1A1MDM2HTR6LMNATSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115884968-B | Novel acid secretion inhibitor and use thereof | 日东制药株式会社 | 2024-06-21 | — | — | CN | claimed |
| CN-115884968-A | Novel acid secretion inhibitor and use thereof | 日东制药株式会社 | 2023-03-31 | — | — | CN | claimed |
| CN-115884968-B | Novel acid secretion inhibitor and use thereof | 日东制药株式会社 | 2024-06-21 | — | — | CN | disclosed |
| CN-115884968-A | Novel acid secretion inhibitor and use thereof | 日东制药株式会社 | 2023-03-31 | — | — | CN | disclosed |