Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12605736 | 0.92 | GAA (0.56) | GAASMN1; SMN2ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL14654216 | 0.85 | GAA (0.58) | GAASMN1; SMN2ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL517174 | 0.84 | ALDH1A1 (0.50) | GAASMN1; SMN2ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL23369804 | 0.80 | GAA (0.58) | GAASMN1; SMN2ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL17192621 | 0.79 | ALDH1A1 (0.44) | GAASMN1; SMN2ALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL5986262 | 0.79 | FFAR3 (0.42) | GAASMN1; SMN2ALDH1A1L3MBTL1MAPK1 | |
| SCHEMBL12310562 | 0.78 | GAA (0.55) | GAASMN1; SMN2ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL29774522 | 0.77 | GAA (0.42) | GAASMN1; SMN2ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL30268155 | 0.77 | ALDH1A1 (0.47) | GAASMN1; SMN2ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL8379452 | 0.76 | HSD11B1 (0.50) | L3MBTL1HTTMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016109217-A2 | BTK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-07-07 | — | — | WO | disclosed |
| WO-2016106627-A1 | BTK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-07-07 | — | — | WO | disclosed |
| WO-2012154249-A1 | SUBSTITUTED AMINOBUTYRIC DERIVATIVES AS NEPRILYSIN INHIBITORS | THERAVANCE, INC. (US) | 2012-11-15 | — | — | WO | disclosed |