Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.35 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3160373 | 0.81 | HTR2A (0.40) | ALDH1A1LMNAAOC3 | |
| SCHEMBL3166467 | 0.81 | HTR2A (0.40) | ALDH1A1LMNAAOC3 | |
| SCHEMBL3169722 | 0.81 | HTR2A (0.40) | ALDH1A1LMNAAOC3 | |
| SCHEMBL3166362 | 0.81 | HTR2A (0.40) | ALDH1A1LMNAAOC3 | |
| SCHEMBL669656 | 0.80 | HTR2A (0.36) | ALDH1A1CALM1CAMKK2AOC3 | |
| SCHEMBL670608 | 0.76 | ALDH1A1 (0.45) | ALDH1A1CALM1CAMKK2AOC3 | |
| SCHEMBL669922 | 0.76 | ALDH1A1 (0.45) | ALDH1A1CALM1CAMKK2AOC3 | |
| SCHEMBL670046 | 0.76 | ALDH1A1 (0.45) | ALDH1A1CALM1CAMKK2AOC3 | |
| Hydrochloric Acid SCHEMBL16742846 | 0.75 | SMN1; SMN2 (0.44) | ALDH1A1CALM1CAMKK2AOC3 | |
| Hydrochloric Acid SCHEMBL670045 | 0.75 | SMN1; SMN2 (0.44) | ALDH1A1CALM1CAMKK2AOC3 |
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-1888506-B1 | SEPARATION OF STEREOISOMERIC N,N-DIALKYLAMINO-2-ALKYL-3-PHENYL ALKANES | GRUENENTHAL GMBH (DE) | 2013-03-20 | — | — | EP | claimed |