Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | LTA4H | P09960 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18933372 | 0.72 | HRH3 (0.47) | NPC1RAB9ALMNAKMT2AALDH1A1 | |
| SCHEMBL27474786 | 0.65 | NPC1 (0.46) | NPC1RAB9ALMNAKMT2AALDH1A1 | |
| SCHEMBL16044574 | 0.64 | CXCR4 (0.58) | NPC1RAB9AKMT2AALDH1A1MEN1 | |
| SCHEMBL1318062 | 0.64 | LTA4H (0.52) | LTA4HALDH1A1 | |
| SCHEMBL18933370 | 0.64 | CSNK1D (0.41) | NPC1RAB9ALMNAKMT2AALDH1A1 | |
| SCHEMBL18933244 | 0.63 | NPC1 (0.52) | NPC1RAB9ALMNAKMT2AALDH1A1 | |
| SCHEMBL1514703 | 0.62 | CXCR4 (0.47) | LMNAKMT2AALDH1A1MEN1 | |
| SCHEMBL30190290 | 0.62 | — | — | |
| SCHEMBL27463476 | 0.60 | PDE10A (0.33) | NPC1RAB9ALMNAKMT2A | |
| SCHEMBL30646560 | 0.60 | HRH3 (0.43) | NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-107949558-A | Muscarinic agonists | 赫普泰雅治疗有限公司 | 2018-04-20 | — | — | CN | disclosed |