Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | RAC1 | P63000 | 2/20 | 0.49 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.48 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.48 |
| ▸ | FYN | P06241 | 3/20 | 0.47 |
| ▸ | ACACA | Q13085 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | DHODH | Q02127 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7699403 | 0.91 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2MAPTGLAGAA | |
| SCHEMBL15881515 | 0.88 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2MAPTGLAGAA | |
| SCHEMBL7697802 | 0.87 | ALOX5 (0.51) | ALDH1A1SMN1; SMN2MAPTGLAGAA | |
| SCHEMBL29149165 | 0.80 | NPC1 (0.66) | ALDH1A1SMN1; SMN2MAPTGLAGAA | |
| SCHEMBL3004664 | 0.79 | NPC1 (0.58) | ALDH1A1SMN1; SMN2MAPTGLAGAA | |
| SCHEMBL16968752 | 0.78 | PIK3CG (0.51) | ALDH1A1SMN1; SMN2MAPTGLAGAA | |
| SCHEMBL30482895 | 0.76 | NPC1 (0.61) | ALDH1A1SMN1; SMN2MAPTGAAKDM4E | |
| SCHEMBL2156854 | 0.76 | NPC1 (0.61) | ALDH1A1SMN1; SMN2MAPTGAAKDM4E | |
| SCHEMBL3024356 | 0.75 | BCHE (0.67) | ALDH1A1SMN1; SMN2MAPTKDM4ENPC1 | |
| SCHEMBL29351353 | 0.74 | SMN1; SMN2 (1.00) | ALDH1A1SMN1; SMN2MAPTGLAGAA |
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-2002094796-A2 | BENZO[G]QUINOXALINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES | AXXIMA PHARMACEUTICALS AG (DE) | 2002-11-28 | — | — | WO | claimed |