Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | PDE10A | Q9Y233 | 9/20 | 0.52 |
| ▸ | ACACA | Q13085 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28002003 | 0.80 | MEN1 (0.55) | KDM4EALDH1A1NPC1NFKB1RAB9A | |
| SCHEMBL1424251 | 0.79 | CYSLTR1 (0.58) | PDE10ACYSLTR1CYSLTR2 | |
| SCHEMBL28002107 | 0.77 | DHFR (0.58) | SMN1; SMN2PDE10ACYP1A2 | |
| SCHEMBL1423762 | 0.75 | CYSLTR1 (0.61) | PDE10ACYSLTR1CYSLTR2 | |
| SCHEMBL13772898 | 0.75 | CYSLTR1 (0.69) | KDM4EALDH1A1NPC1NFKB1RAB9A | |
| SCHEMBL17761067 | 0.74 | NPC1 (0.59) | KDM4EALDH1A1NPC1NFKB1RAB9A | |
| SCHEMBL4375331 | 0.74 | PPARA (0.53) | NPC1RAB9ASMN1; SMN2LMNAL3MBTL1 | |
| SCHEMBL14911661 | 0.73 | PDE10A (0.48) | KDM4EALDH1A1NPC1NFKB1RAB9A | |
| SCHEMBL14351769 | 0.73 | PDE10A (0.48) | KDM4EALDH1A1NPC1NFKB1RAB9A | |
| SCHEMBL10547475 | 0.73 | CYSLTR1 (0.76) | PDE10ACYSLTR1CYSLTR2 |
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-2303863-A1 | 5- AND 6-MEMBERED HETEROCYCLIC COMPOUNDS | Envivo Pharmaceuticals, Inc. (US) | 2011-04-06 | — | — | EP | disclosed |