Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 6/20 | 0.52 |
| ▸ | MAOA | P21397 | 5/20 | 0.52 |
| ▸ | RAB9A | P51151 | 6/20 | 0.52 |
| ▸ | NPC1 | O15118 | 5/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | VNN1 | O95497 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | KLF5 | Q13887 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL2394692 | 1.00 | MAOB (0.52) | MAOBMAOARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2395648 | 0.86 | NPC1 (0.50) | MAOBMAOARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2395645 | 0.86 | NPC1 (0.50) | MAOBMAOARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2394571 | 0.83 | NPC1 (0.62) | MAOBMAOARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2394568 | 0.83 | NPC1 (0.62) | MAOBMAOARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL5469763 | 0.80 | NPC1 (0.47) | MAOBMAOARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL5469767 | 0.80 | NPC1 (0.47) | MAOBMAOARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL11800727 | 0.76 | MAPT (0.58) | MAOBMAOARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL11787988 | 0.76 | MAPT (0.53) | MAOBMAOARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL11800720 | 0.76 | MAPT (0.58) | MAOBMAOARAB9ANPC1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8012901-B1 | Method of synthesizing enantiopure mexiletine analogues and novel β-thiophenoxy and pyridyl ethers | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2011-09-06 | — | — | US | disclosed |