Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | MITF | O75030 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 5/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30570 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL308872 | 0.75 | — | — | |
| SCHEMBL4805121 | 0.75 | — | — | |
| Fluoride SCHEMBL27659500 | 0.75 | — | — | |
| Methane SCHEMBL9114544 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL341033 | 0.75 | — | — | |
| Water SCHEMBL20546842 | 0.75 | — | — | |
| SCHEMBL442721 | 0.75 | GSK3B (0.36) | HTTALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL10886301 | 0.75 | GSK3B (0.70) | ALDH1A1SMN1; SMN2RAB9AGSK3BTRPA1 | |
| SCHEMBL28056125 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0569276-B1 | Novel use of enantiomers derived from (S)-2-amino-3-(3,4-dichlorobenzyl)-1-propanol | JOUVEINAL INST RECH (FR) | 1997-01-29 | — | — | EP | disclosed |
| EP-0569276-A1 | Novel use of enantiomers derived from (S)-2-amino-3-(3,4-dichlorobenzyl)-1-propanol | INSTITUT DE RECHERCHE JOUVEINAL (I.R.J) (FR) | 1993-11-10 | — | — | EP | disclosed |