Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18723610 | 1.00 | ALDH1A1 (0.33) | ALDH1A1HPGDHTTL3MBTL1NR2E3 | |
| SCHEMBL2034212 | 0.95 | ALDH1A1 (0.30) | ALDH1A1HPGDNR2E3 | |
| SCHEMBL12644781 | 0.88 | HTR2A (0.34) | — | |
| SCHEMBL12644764 | 0.88 | HTR2A (0.34) | — | |
| SCHEMBL18723783 | 0.81 | HPGD (0.32) | ALDH1A1HPGDHTTL3MBTL1LMNA | |
| SCHEMBL18723757 | 0.81 | HPGD (0.32) | ALDH1A1HPGDHTTL3MBTL1LMNA | |
| SCHEMBL18723758 | 0.76 | HTR6 (0.33) | — | |
| SCHEMBL2041691 | 0.76 | HTR6 (0.33) | ALDH1A1HPGDHTTL3MBTL1 | |
| SCHEMBL12644276 | 0.73 | SIGMAR1 (0.34) | ALDH1A1HPGD | |
| SCHEMBL12644105 | 0.73 | ALDH1A1 (0.33) | ALDH1A1HPGDHTTL3MBTL1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2507245-B1 | MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF | SUNOVION PHARMACEUTICALS INC (US) | 2017-04-12 | — | — | EP | disclosed |