Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11922959 | 0.83 | L3MBTL1 (0.70) | LMNAKDM4EL3MBTL1ALDH1A1MAPT | |
| SCHEMBL2746245 | 0.80 | CA12 (0.50) | LMNAKDM4EL3MBTL1ALDH1A1MAPT | |
| SCHEMBL20642257 | 0.78 | CA1 (0.59) | LMNAKDM4EL3MBTL1ALDH1A1MAPT | |
| SCHEMBL5542466 | 0.78 | PDK1 (0.56) | LMNAL3MBTL1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL3047342 | 0.77 | ALDH1A1 (0.47) | LMNAKDM4EL3MBTL1ALDH1A1MAPT | |
| SCHEMBL12206007 | 0.77 | HPGD (0.49) | LMNAKDM4EL3MBTL1ALDH1A1MAPT | |
| SCHEMBL5542669 | 0.75 | HSD17B10 (0.51) | LMNAKDM4EL3MBTL1ALDH1A1MAPT | |
| SCHEMBL6816043 | 0.75 | CYP17A1 (0.49) | LMNAKDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL3047347 | 0.74 | HPGD (0.49) | LMNAKDM4EL3MBTL1ALDH1A1MAPT | |
| SCHEMBL19329702 | 0.73 | KEAP1 (0.59) | LMNAKDM4ENPSR1ALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8367666-B2 | 3-carbamoyl-2-pyridone derivatives | SHIONOGI & CO., LTD. (JP) | 2013-02-05 | — | — | US | disclosed |
| 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 |