Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | GFER | P55789 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | SMO | Q99835 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL14679338 | 0.85 | POLB (0.54) | POLBLMNAKDM4ESMN1; SMN2RAB9A | |
| SCHEMBL5533967 | 0.81 | HDAC8 (0.54) | POLBLMNASMN1; SMN2RAB9ANPC1 | |
| SCHEMBL7495727 | 0.77 | POLB (0.69) | POLBLMNAKDM4ESMN1; SMN2RAB9A | |
| SCHEMBL13753398 | 0.76 | KDM4E (0.58) | POLBLMNAKDM4ESMN1; SMN2RAB9A | |
| SCHEMBL13701704 | 0.76 | LMNA (0.56) | POLBLMNAKDM4ESMN1; SMN2RAB9A | |
| SCHEMBL13753411 | 0.74 | POLB (0.54) | POLBLMNAKDM4ESMN1; SMN2RAB9A | |
| SCHEMBL6497629 | 0.72 | POLB (0.63) | POLBLMNAKDM4ESMN1; SMN2RAB9A | |
| SCHEMBL31490713 | 0.72 | POLB (0.59) | POLBLMNAKDM4ESMN1; SMN2RAB9A | |
| SCHEMBL15893980 | 0.71 | KMT2A (0.50) | POLBLMNAKDM4ESMN1; SMN2RAB9A | |
| SCHEMBL16886343 | 0.71 | KMT2A (0.50) | POLBLMNAKDM4ESMN1; SMN2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-8178681-B2 | methyl 3-methyl-2-{[2-oxo-1-(2-oxo-ethyl)-1,2,5,6,7,8,9,10-octahydro-cycloocta[b]pyridine-3-carbonyl]-amino}-butyrate; cannabinoid receptor agonist; antiinflammatory agent, immunostimulant, analgesic; atopic dermatitis; excellent in photostability, and have excellent transdermal and oral absorbency | SHIONOGI & CO., LTD. (JP) | 2012-05-15 | — | — | US | disclosed |