Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.53 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.39 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | SRR | Q9GZT4 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | LAP3 | P28838 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29168029 | 0.86 | SCN9A (0.44) | SCN9ACTSLPPARGPPARAMAPT | |
| SCHEMBL29229250 | 0.86 | PPARA (0.42) | SCN9ACTSLCTSBCTSKPPARG | |
| SCHEMBL20524457 | 0.86 | FAAH (0.44) | FAAHCTSLCTSBCTSKPPARG | |
| SCHEMBL29168191 | 0.83 | PPARG (0.39) | SCN9ACTSKPPARGPPARAHPGD | |
| SCHEMBL28753334 | 0.82 | SCN9A (0.51) | SCN9APPARGPPARANPC1RAB9A | |
| SCHEMBL27502333 | 0.81 | SCN9A (0.57) | SCN9ACTSLCTSBCTSKPPARG | |
| SCHEMBL28487501 | 0.80 | SRR (0.46) | FAAHPPARGPPARASRRHPGD | |
| SCHEMBL28336154 | 0.80 | SCN9A (0.56) | SCN9ACTSLCTSBCTSKPPARG | |
| SCHEMBL29168226 | 0.78 | POLB (0.33) | SCN9AFAAHJAK3BTK | |
| SCHEMBL28506240 | 0.78 | POLB (0.33) | SCN9AFAAHJAK3BTK |
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-112368263-B | Dipeptidyl ketoamide m-methoxyphenyl derivative and application thereof | 兰德施泰纳根梅德公司 | 2023-09-26 | — | — | CN | disclosed |
| CN-112368263-A | Dipeptidyl ketoamide m-methoxyphenyl derivative and application thereof | 兰德施泰纳根梅德公司 | 2021-02-12 | — | — | CN | disclosed |