Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5015066 | 0.86 | ALDH1A1 (0.34) | ALDH1A1GABRA1GABRB2NOS3NOS1 | |
| SCHEMBL3669420 | 0.83 | ALDH1A1 (0.48) | ALDH1A1NOS3NOS1NOS2CYP1A2 | |
| SCHEMBL6572888 | 0.80 | ALDH1A1 (0.61) | ALDH1A1GABRA1GABRB2NOS3NOS1 | |
| Hydrochloric Acid SCHEMBL4115150 | 0.80 | ALDH1A1 (0.46) | ALDH1A1NOS3NOS1NOS2CYP1A2 | |
| SCHEMBL14957365 | 0.78 | ALDH1A1 (0.44) | ALDH1A1NOS3NOS1NOS2CYP1A2 | |
| SCHEMBL11851884 | 0.77 | ALDH1A1 (0.46) | ALDH1A1GABRA1GABRB2NOS3NOS1 | |
| SCHEMBL23387413 | 0.76 | GABRA1 (0.52) | ALDH1A1GABRA1GABRB2ALOX15CASP7 | |
| SCHEMBL22863402 | 0.76 | GABRA1 (0.34) | ALDH1A1GABRA1GABRB2 | |
| SCHEMBL2683313 | 0.76 | CYP1A2 (0.37) | ALDH1A1GABRA1GABRB2CYP1A2 | |
| SCHEMBL10019203 | 0.76 | LMNA (0.39) | ALDH1A1GABRA1GABRB2ALOX15 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008137102-A2 | METHODS OF MODULATING AMYLOID BETA AND COMPOUNDS USEFUL THEREFOR | TORREYPINES THERAPEUTICS, INC. (US) | 2008-11-13 | — | — | WO | disclosed |
| WO-2008137102-A2 | METHODS OF MODULATING AMYLOID BETA AND COMPOUNDS USEFUL THEREFOR | TORREYPINES THERAPEUTICS, INC. (US) | 2008-11-13 | — | — | WO | disclosed |