Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11786619 | 0.75 | SMN1; SMN2 (0.38) | SMN1; SMN2ALDH1A1RAB9ALMNAPOLB | |
| SCHEMBL5069784 | 0.73 | CYP2C19 (0.44) | SLC6A2SLC6A4SLC6A3TSHRNPSR1 | |
| SCHEMBL10956473 | 0.73 | SLC6A2 (0.38) | SMN1; SMN2ALDH1A1LMNATP53SLC6A2 | |
| SCHEMBL5071497 | 0.73 | NFE2L2 (0.38) | SMN1; SMN2ALDH1A1RAB9ALMNAL3MBTL1 | |
| SCHEMBL6194805 | 0.73 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1RAB9ALMNAPOLB | |
| SCHEMBL1515754 | 0.72 | SLC6A2 (0.57) | ALDH1A1RAB9ALMNASLC6A2SLC6A4 | |
| SCHEMBL3904396 | 0.70 | SLC6A2 (0.42) | SMN1; SMN2ALDH1A1RAB9ALMNANPC1 | |
| SCHEMBL20681680 | 0.69 | NQO1 (0.40) | ALDH1A1SLC6A2SLC6A4SLC6A3NPSR1 | |
| SCHEMBL20681679 | 0.68 | RAB9A (0.45) | SMN1; SMN2ALDH1A1RAB9ALMNAL3MBTL1 | |
| SCHEMBL702800 | 0.68 | CYP3A4 (0.46) | SMN1; SMN2ALDH1A1RAB9ALMNANPC1 |
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-2632918-A1 | ALPHA-7 NICOTINIC RECEPTOR MODULATORS FOR THE TREATMENT OF PAIN, A PSYCHOTIC DISORDER, COGNITIVE IMPAIRMENT OR ALZHEIMER'S DISEASE | Proximagen Limited (GB) | 2013-09-04 | — | — | EP | disclosed |
| WO-2012055942-A1 | ALPHA-7 NICOTINIC RECEPTOR MODULATORS FOR THE TREATMENT OF PAIN, A PSYCHOTIC DISORDER, COGNITIVE IMPAIRMENT OR ALZHEIMER'S DISEASE | PROXIMAGEN LIMITED (GB) | 2012-05-03 | — | — | WO | disclosed |