Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 2/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL9196291 | 1.00 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1HTTCYP46A1RAB9A | |
| SCHEMBL9197533 | 0.89 | MEN1 (0.55) | ALDH1A1RAB9AMAPTSMN1; SMN2MEN1 | |
| SCHEMBL9203068 | 0.89 | MEN1 (0.55) | ALDH1A1RAB9AMAPTSMN1; SMN2MEN1 | |
| SCHEMBL9197568 | 0.82 | NPC1 (0.52) | ALDH1A1RAB9AMAPTTSHRSMN1; SMN2 | |
| SCHEMBL9196003 | 0.82 | MEN1 (0.52) | RAB9ASMN1; SMN2MEN1NPC1KMT2A | |
| SCHEMBL9196005 | 0.82 | MEN1 (0.52) | RAB9ASMN1; SMN2MEN1NPC1KMT2A | |
| SCHEMBL9202485 | 0.80 | MEN1 (0.44) | ALDH1A1RAB9AMAPTSMN1; SMN2MEN1 | |
| SCHEMBL9202491 | 0.80 | MEN1 (0.44) | ALDH1A1RAB9AMAPTSMN1; SMN2MEN1 | |
| SCHEMBL9199454 | 0.77 | L3MBTL1 (0.54) | ALDH1A1L3MBTL1RAB9ATSHRMEN1 | |
| SCHEMBL1116630 | 0.77 | ALDH1A1 (0.78) | ALDH1A1L3MBTL1HTTCYP46A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0431580-B1 | Substituted cyclohexanols as central nervous system agents | WARNER LAMBERT CO (US) | 1995-03-08 | — | — | EP | claimed |