Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.75 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.75 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.75 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.75 |
| ▸ | LMNA | P02545 | 2/20 | 0.75 |
| ▸ | GBA1 | P04062 | 1/20 | 0.75 |
| ▸ | CNR1 | P21554 | 1/20 | 0.75 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.75 |
| ▸ | HRH2 | P25021 | 1/20 | 0.75 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.75 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.73 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.73 |
| ▸ | TSHR | P16473 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 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 | |
|---|---|---|---|---|
| Ambroxol SCHEMBL18702 | 0.86 | CYP2D6 (1.00) | CYP2D6CYP1A2SLC6A4KCNH2LMNA | |
| Ambroxol SCHEMBL423712 | 0.86 | CYP2D6 (1.00) | CYP2D6CYP1A2SLC6A4KCNH2LMNA | |
| Ambroxol SCHEMBL29380194 | 0.86 | CYP2D6 (1.00) | CYP2D6CYP1A2SLC6A4KCNH2LMNA | |
| Ambroxol SCHEMBL28472066 | 0.86 | CYP2D6 (1.00) | CYP2D6CYP1A2SLC6A4KCNH2LMNA | |
| Ambroxol SCHEMBL7855003 | 0.86 | CYP2D6 (1.00) | CYP2D6CYP1A2SLC6A4KCNH2LMNA | |
| Ambroxol SCHEMBL6601413 | 0.84 | CYP3A4 (1.00) | CYP2D6CYP1A2SLC6A4KCNH2LMNA | |
| Ambroxol SCHEMBL99455 | 0.84 | CYP3A4 (1.00) | CYP2D6CYP1A2SLC6A4KCNH2LMNA | |
| SCHEMBL11623963 | 0.84 | LMNA (0.71) | CYP2D6CYP1A2SLC6A4KCNH2LMNA | |
| SCHEMBL13921508 | 0.83 | CYP1A2 (0.56) | CYP2D6CYP1A2SLC6A4KCNH2LMNA | |
| Ambroxol SCHEMBL1648757 | 0.83 | CYP2D6 (0.94) | CYP2D6CYP1A2SLC6A4KCNH2LMNA |
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-2200596-B1 | METHOD OF TREATING GAUCHER DISEASE | HOSPITAL FOR SICK CHILDREN (CA) | 2012-06-13 | — | — | EP | disclosed |