Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9153991 | 0.82 | ALDH1A1 (0.56) | ALDH1A1KMT2ACA12CA9MEN1 | |
| SCHEMBL9154000 | 0.82 | ALDH1A1 (0.56) | ALDH1A1KMT2ACA12CA9MEN1 | |
| SCHEMBL9157809 | 0.79 | ALDH1A1 (0.62) | ALDH1A1KMT2ACA12CA9MEN1 | |
| SCHEMBL4560573 | 0.77 | ALDH1A1 (0.51) | ALDH1A1NPC1MAPK1 | |
| SCHEMBL4558955 | 0.76 | ALDH1A1 (0.50) | ALDH1A1POLBGAA | |
| SCHEMBL4561031 | 0.75 | TP53 (0.54) | ALDH1A1POLBCYP3A4 | |
| SCHEMBL29398039 | 0.74 | L3MBTL1 (0.63) | ALDH1A1KMT2ACA12CA9MEN1 | |
| SCHEMBL4558972 | 0.74 | LMNA (0.47) | ALDH1A1POLB | |
| SCHEMBL9155385 | 0.73 | ALDH1A1 (0.47) | ALDH1A1KMT2ACA12CA9MEN1 | |
| SCHEMBL8860030 | 0.72 | CA12 (0.60) | ALDH1A1KMT2ACA12CA9MEN1 |
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-1833797-A1 | AZACYCLIC COMPOUNDS AS INHBITORS OF SENSORY NEURONE SPECIFIC CHANNELS (SNS) | VERNALIS (R&D) LTD (GB) | 2007-09-19 | — | — | EP | disclosed |
| WO-2006082354-A1 | AZACYCLIC COMPOUNDS AS INHIBITORS OF SENSORY NEURONE SPECIFIC CHANNELS ( SNS ) | VERNALIS (R & D) LIMITED (GB) | 2006-08-10 | — | — | WO | disclosed |