Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP12 | P39900 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | RHEB | Q15382 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7708631 | 0.84 | L3MBTL1 (0.45) | CYP2C9CYP2C19HPGDAGBL2L3MBTL1 | |
| SCHEMBL11707313 | 0.83 | SLC6A4 (0.61) | CYP2C9CYP2C19L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL11006463 | 0.83 | CYP2C9 (0.60) | CYP2C9CYP2C19HPGDAGBL2L3MBTL1 | |
| SCHEMBL11664111 | 0.83 | HPGD (0.55) | CYP2C9CYP2C19HPGDAGBL2L3MBTL1 | |
| SCHEMBL8229735 | 0.83 | CYP2C9 (0.72) | CYP2C9CYP2C19HPGDAGBL2L3MBTL1 | |
| SCHEMBL11705979 | 0.81 | CYP2C9 (0.54) | CYP2C9CYP2C19HPGDAGBL2L3MBTL1 | |
| SCHEMBL11709416 | 0.81 | AGBL2 (0.71) | CYP2C9CYP2C19HPGDAGBL2L3MBTL1 | |
| SCHEMBL3765157 | 0.80 | HPGD (0.78) | CYP2C9CYP2C19HPGDAGBL2L3MBTL1 | |
| SCHEMBL11711077 | 0.79 | SLC6A4 (0.46) | CYP2C9CYP2C19HPGDL3MBTL1CYP1A2 | |
| SCHEMBL11146928 | 0.78 | SLC6A2 (0.46) | HPGDL3MBTL1CYP3A4SLC6A2SLC6A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011130741-A1 | COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES | ARRAY BIOPHARMA INC. (US) | 2011-10-20 | — | — | WO | disclosed |
| WO-2011130741-A1 | COMPOUNDS FOR TREATING NEURODEGENERATIVE DISEASES | ARRAY BIOPHARMA INC. (US) | 2011-10-20 | — | — | WO | disclosed |
| US-4006145-A | CNS DEPRESSANTS, NEUROLEPTICS | HOFFMANN-LA ROCHE INC. (US) | 1977-02-01 | — | — | US | disclosed |
| US-4006144-A | CNS DEPRESSANTS, NEUROLEPTICS | HOFFMANN-LA ROCHE INC. (US) | 1977-02-01 | — | — | US | disclosed |