Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | NAAA | Q02083 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.53 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.53 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.53 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL12895459 | 0.99 | NPC1 (0.57) | NPC1TDP1NAAAALDH1A1LMNA | |
| SCHEMBL13068970 | 0.88 | ENPP2 (0.53) | NPC1TDP1ENPP2ATXN2EPHX2 | |
| SCHEMBL17761198 | 0.85 | ALDH1A1 (0.59) | TDP1ALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL19506302 | 0.84 | HRH3 (0.67) | NPC1HPGDSMN1; SMN2MEN1KMT2A | |
| SCHEMBL16615993 | 0.82 | ENPP2 (0.61) | ALDH1A1MEN1KMT2AENPP2ATXN2 | |
| SCHEMBL25234683 | 0.81 | ENPP2 (0.58) | ALDH1A1MEN1KMT2AENPP2ATXN2 | |
| SCHEMBL16963832 | 0.81 | ENPP2 (0.48) | ALDH1A1POLBKMT2AENPP2ATXN2 | |
| SCHEMBL25234685 | 0.81 | ENPP2 (0.58) | ALDH1A1MEN1KMT2AENPP2ATXN2 | |
| SCHEMBL10305162 | 0.81 | FKBP1A (0.76) | NPC1TDP1NAAAALDH1A1LMNA | |
| SCHEMBL22813668 | 0.81 | HRH3 (0.67) | NPC1TDP1NAAAALDH1A1LMNA |
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-2011034849-A1 | NOVEL COMPOUNDS ADVANTAGEOUS IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES AND DISORDERS | AURIMED PHARMA, INC. (US) | 2011-03-24 | — | — | WO | disclosed |