Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | APAF1 | O14727 | 1/20 | 0.32 |
| ▸ | TDP2 | O95551 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | RAD52 | P43351 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 2/20 | 0.31 |
| ▸ | CCNC | P24863 | 1/20 | 0.30 |
| ▸ | CDK8 | P49336 | 1/20 | 0.30 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.30 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.30 |
| ▸ | ATG4B | Q9Y4P1 | 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 | |
|---|---|---|---|---|
| SCHEMBL11185934 | 0.82 | MAPT (0.36) | ALDH1A1MAPTGLAAPAF1TDP2 | |
| SCHEMBL9752735 | 0.81 | OPRD1 (0.33) | ALDH1A1MAPTGLAAPAF1TDP2 | |
| SCHEMBL9354700 | 0.81 | MAPT (0.33) | ALDH1A1MAPTGLACTDSP1OPRD1 | |
| SCHEMBL8482855 | 0.78 | CTDSP1 (0.35) | ALDH1A1MAPTGLACTDSP1OPRD1 | |
| SCHEMBL13009960 | 0.72 | IDO1 (0.34) | ALDH1A1MAPTGLACTDSP1OPRD1 | |
| Hydrochloric Acid SCHEMBL11476731 | 0.72 | ALDH1A1 (0.33) | ALDH1A1MAPTGLAAPAF1OPRD1 | |
| SCHEMBL68917 | 0.71 | ALDH1A1 (0.50) | ALDH1A1MAPTHPGDIDO1PLA2G1B | |
| SCHEMBL29833582 | 0.71 | PDK2 (0.34) | ALDH1A1MAPTGLAKCNH2HPGD | |
| SCHEMBL346891 | 0.71 | PDK2 (0.34) | ALDH1A1MAPTGLAKCNH2HPGD | |
| SCHEMBL7553889 | 0.70 | MAOB (0.38) | IDO1 |
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-1998034646-A2 | TARGETED ANTIOXIDANTS | UNIVERSITY OF HERTFORDSHIRE (GB) | 1998-08-13 | — | — | WO | disclosed |