Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | NOS3 | P29474 | 1/20 | 0.54 |
| ▸ | NOS2 | P35228 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4070279 | 0.86 | GAA (0.57) | GAANOS3NOS2L3MBTL1THRB | |
| SCHEMBL9201177 | 0.86 | GAA (0.57) | GAANOS3NOS2L3MBTL1THRB | |
| SCHEMBL9198765 | 0.84 | GAA (0.56) | GAANOS3NOS2L3MBTL1THRB | |
| SCHEMBL8434541 | 0.83 | GAA (0.62) | GAANOS3NOS2L3MBTL1THRB | |
| SCHEMBL9697742 | 0.82 | GAA (0.40) | GAANOS3NOS2L3MBTL1THRB | |
| SCHEMBL1267275 | 0.81 | GAA (0.61) | GAANOS3NOS2L3MBTL1THRB | |
| Hydrochloric Acid SCHEMBL3876686 | 0.81 | GAA (0.53) | GAANOS3NOS2L3MBTL1THRB | |
| SCHEMBL8692211 | 0.81 | GAA (0.61) | GAANOS3NOS2L3MBTL1THRB | |
| SCHEMBL22722003 | 0.81 | GAA (0.39) | GAANOS3NOS2L3MBTL1THRB | |
| SCHEMBL9198547 | 0.81 | GAA (0.56) | GAANOS3NOS2L3MBTL1THRB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2189447-A1 | Enantioselective alkylation of tricyclic compounds | SCHERING CORPORATION (US) | 2010-05-26 | — | — | EP | disclosed |
| US-7582763-B2 | Enantioselective process | SCHERING CORPORATION (US) | 2009-09-01 | — | — | US | disclosed |
| US-7582763-B2 | Enantioselective process | SCHERING CORPORATION (US) | 2009-09-01 | — | — | US | disclosed |