Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.41 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | TEAD1 | P28347 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | GNRHR | P30968 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 3/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.37 |
| ▸ | LSS | P48449 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29710313 | 0.85 | SIGMAR1 (0.44) | ALDH1A1LMNAHTR2CDRD4DRD2 | |
| SCHEMBL19357722 | 0.85 | SIGMAR1 (0.44) | ALDH1A1LMNAHTR2CDRD4DRD2 | |
| SCHEMBL5240721 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TSHRTNFNOD2NOD1 | |
| SCHEMBL5243815 | 0.76 | ALDH1A1 (0.52) | ALDH1A1TSHRTNFNOD2NOD1 | |
| SCHEMBL2019631 | 0.75 | GRM2 (0.42) | ALDH1A1TSHRHCRTR1HCRTR2 | |
| SCHEMBL5240643 | 0.74 | ALDH1A1 (0.50) | ALDH1A1TSHRTNFNOD2NOD1 | |
| SCHEMBL5239908 | 0.73 | ALDH1A1 (0.52) | ALDH1A1TSHRTNFNOD2NOD1 | |
| SCHEMBL2056301 | 0.73 | ALDH1A1 (0.58) | ALDH1A1TSHRTNFNOD2NOD1 | |
| SCHEMBL5242288 | 0.71 | ALDH1A1 (0.44) | ALDH1A1TSHRTNFNOD2NOD1 | |
| SCHEMBL5241430 | 0.71 | ALDH1A1 (0.52) | ALDH1A1TSHRTNFNOD2NOD1 |
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 |