Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | PDE1A | P54750 | 1/20 | 0.38 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.38 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TXN | P10599 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23619188 | 0.81 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1SMN1; SMN2SCN10AKCNH2 | |
| SCHEMBL10005347 | 0.80 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1SMN1; SMN2SCN10AKCNH2 | |
| SCHEMBL846855 | 0.80 | SCN10A (0.58) | ALDH1A1L3MBTL1SMN1; SMN2SCN10AKCNH2 | |
| SCHEMBL7028984 | 0.79 | KDM4E (0.50) | ALDH1A1L3MBTL1SMN1; SMN2SCN10AKCNH2 | |
| SCHEMBL14491782 | 0.79 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1SMN1; SMN2SCN10AKCNH2 | |
| SCHEMBL2732982 | 0.79 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1SMN1; SMN2SCN10AKCNH2 | |
| SCHEMBL10248397 | 0.79 | SMN1; SMN2 (0.45) | ALDH1A1L3MBTL1SMN1; SMN2SCN10AKCNH2 | |
| SCHEMBL846648 | 0.77 | KDM4E (0.56) | ALDH1A1L3MBTL1SMN1; SMN2SCN10AKCNH2 | |
| SCHEMBL5988285 | 0.76 | SMN1; SMN2 (0.43) | ALDH1A1L3MBTL1SMN1; SMN2SCN10AKCNH2 | |
| SCHEMBL868599 | 0.76 | SMN1; SMN2 (0.43) | ALDH1A1L3MBTL1SMN1; SMN2SCN10AKCNH2 |
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-2010084767-A1 | N-SUBSTITUTED SATURATED HETEROCYCLIC SULFONE COMPOUNDS WITH CB2 RECEPTOR AGONISTIC ACTIVITY | RAQUALIA PHARMA INC. (JP) | 2010-07-29 | — | — | WO | disclosed |