Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | AKR1B10 | O60218 | 3/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | SLC26A4 | O43511 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 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 | |
|---|---|---|---|---|
| SCHEMBL13582375 | 0.88 | PTGER3 (0.44) | SMN1; SMN2MAPTMAOAMAOBMEN1 | |
| SCHEMBL13582372 | 0.88 | PTGER3 (0.44) | SMN1; SMN2MAPTMAOAMAOBMEN1 | |
| SCHEMBL2233912 | 0.87 | ACACB (0.41) | AKR1B10AKR1B1MAOBACACBL3MBTL1 | |
| SCHEMBL13583137 | 0.84 | APP (0.43) | SMN1; SMN2MAPTTHRBMEN1KMT2A | |
| SCHEMBL13583139 | 0.84 | APP (0.43) | SMN1; SMN2MAPTTHRBMEN1KMT2A | |
| SCHEMBL2235546 | 0.83 | ALOX5 (0.46) | — | |
| SCHEMBL2235542 | 0.79 | NR4A2 (0.41) | SMN1; SMN2MAPTTHRBMAOAMAOB | |
| SCHEMBL13582816 | 0.79 | MEN1 (0.43) | SMN1; SMN2MAPTTHRBMAOAMAOB | |
| SCHEMBL13582813 | 0.79 | MEN1 (0.43) | SMN1; SMN2MAPTTHRBMAOAMAOB | |
| SCHEMBL2231809 | 0.78 | ACACB (0.38) | AKR1B10AKR1B1EGFRERBB2MAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011093524-A1 | DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2011-08-04 | — | — | WO | disclosed |