Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | PRCP | P42785 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.40 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | BACE1 | P56817 | 2/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.38 |
| ▸ | TEAD1 | P28347 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5243101 | 0.88 | ABCB1 (0.44) | ALDH1A1LMNAHTR2C | |
| SCHEMBL5243815 | 0.88 | ALDH1A1 (0.52) | ALDH1A1TSHRPRCPLMNATNF | |
| SCHEMBL5239908 | 0.84 | ALDH1A1 (0.52) | ALDH1A1TSHRLMNATNFNOD2 | |
| SCHEMBL2022219 | 0.76 | GRM2 (0.46) | ALDH1A1TSHRHTR2CGRIN2BHCRTR1 | |
| SCHEMBL5240721 | 0.76 | ALDH1A1 (0.50) | ALDH1A1TSHRLMNATNFNOD2 | |
| SCHEMBL5243418 | 0.75 | ALDH1A1 (0.50) | ALDH1A1TSHRLMNATNFNOD2 | |
| SCHEMBL5241430 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TSHRLMNATNFNOD2 | |
| SCHEMBL5242452 | 0.74 | ALDH1A1 (0.51) | ALDH1A1TSHRLMNATNFNOD2 | |
| SCHEMBL27685020 | 0.72 | HCRTR1 (0.40) | ALDH1A1TSHRHTR2CHCRTR1HCRTR2 | |
| SCHEMBL2056301 | 0.72 | ALDH1A1 (0.58) | ALDH1A1TSHRLMNATNFNOD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1778634-A1 | ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS | AstraZeneca AB (SE) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006020879-A1 | ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS | ASTRAZENECA AB (SE) | 2006-02-23 | — | — | WO | disclosed |