Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14968794 | 0.86 | SMN1; SMN2 (0.41) | SLC6A2SLC6A4SLC6A3SMN1; SMN2ALDH1A1 | |
| SCHEMBL15322838 | 0.82 | MAPT (0.45) | SMN1; SMN2ALDH1A1POLBGAA | |
| SCHEMBL25277684 | 0.82 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL28798049 | 0.82 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL25225141 | 0.82 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL13390607 | 0.81 | PDE4B (0.48) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL30453781 | 0.81 | PDE4B (0.48) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL1445046 | 0.81 | PDE4B (0.48) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL8221976 | 0.81 | PDE4B (0.48) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL13390675 | 0.81 | PDE4B (0.48) | SMN1; SMN2ALDH1A1 |
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-2734529-A1 | BTK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2014-05-28 | — | — | EP | disclosed |
| WO-2013010380-A1 | BTK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2013-01-24 | — | — | WO | disclosed |