Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | MARK3 | P27448 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL27008525 | 0.86 | MAP4K1 (0.37) | LMNAALDH1A1NPY5RLRRK2KCNH2 | |
| SCHEMBL20641873 | 0.85 | NAMPT (0.43) | — | |
| SCHEMBL31195181 | 0.81 | FAAH (0.39) | FAAHLMNAALDH1A1MAP4K1HPGD | |
| SCHEMBL26619952 | 0.81 | FAAH (0.39) | FAAHLMNAALDH1A1MAP4K1HPGD | |
| SCHEMBL27008482 | 0.78 | EPHX2 (0.44) | FAAHHTTNPC1RAB9ALMNA | |
| SCHEMBL27008627 | 0.78 | EPHX2 (0.44) | FAAHHTTNPC1RAB9ALMNA | |
| SCHEMBL27008496 | 0.77 | SMN1; SMN2 (0.43) | HTTNPC1RAB9ALMNAALDH1A1 | |
| SCHEMBL27008607 | 0.77 | SMN1; SMN2 (0.43) | HTTNPC1RAB9ALMNAALDH1A1 | |
| SCHEMBL27008487 | 0.77 | HCRTR2 (0.50) | HTTNPC1RAB9AALDH1A1EPHX2 | |
| SCHEMBL27008613 | 0.77 | HCRTR2 (0.50) | HTTNPC1RAB9AALDH1A1EPHX2 |
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-110891569-A | Antagonists of muscarinic acetylcholine receptor M4 | 范德堡大学 | 2020-03-17 | — | — | CN | disclosed |