Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 12/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 7/20 | 0.48 |
| ▸ | HPGDS | O60760 | 1/20 | 0.35 |
| ▸ | CPA1 | P15085 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 2/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7666645 | 0.81 | TDP1 (0.33) | GSK3BPTPN1CES1CES2KDM4E | |
| SCHEMBL11257239 | 0.81 | CES1 (0.33) | GSK3BPTPN1CES1CES2KDM4E | |
| SCHEMBL989057 | 0.79 | SMN1; SMN2 (0.42) | CES1CES2KDM4EMEN1CYP3A4 | |
| SCHEMBL7516064 | 0.79 | ALDH1A1 (0.48) | GSK3BCES1CES2KDM4EMEN1 | |
| SCHEMBL8407064 | 0.78 | L3MBTL1 (0.50) | CES1MEN1MAPTKMT2ATDP1 | |
| SCHEMBL3268222 | 0.78 | MAPK1 (0.40) | GSK3BPTPN1CES1CES2KDM4E | |
| SCHEMBL3248948 | 0.78 | CES1 (0.50) | CES1CES2MEN1MAPTHPGD | |
| SCHEMBL1714625 | 0.76 | PAM (0.32) | CES1CES2KDM4EMEN1CYP3A4 | |
| SCHEMBL2332592 | 0.76 | HPGD (0.46) | CES1CES2CYP3A4MAPTHPGD | |
| SCHEMBL1727779 | 0.76 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2421855-A1 | DIARYL ETHERS | Tibotec Pharmaceuticals (IE) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010122162-A1 | DIARYL ETHERS | TIBOTEC PHARMACEUTICALS (IE) | 2010-10-28 | — | — | WO | disclosed |
| US-7049445-B2 | Bicyclic compounds | ASAHI KASEI PHARMA CORPORATION (JP) | 2006-05-23 | — | — | US | disclosed |
| US-6861444-B2 | Bicyclic compounds | ASAHI KASEI PHARMA CORPORATION (JP) | 2005-03-01 | — | — | US | disclosed |
| US-4290943-A | Method of preparing polypeptides | MAX-PLANK-GESELLSCHAFT (DE) | 1981-09-22 | — | — | US | disclosed |
| US-4290943-A | Method of preparing polypeptides | MAX-PLANK-GESELLSCHAFT (DE) | 1981-09-22 | — | — | US | disclosed |