Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 8/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.36 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.36 |
| ▸ | PTGIR | P43119 | 1/20 | 0.36 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | SLC27A1 | Q6PCB7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4172587 | 0.87 | HCAR3 (0.40) | HDAC1TSHRALDH1A1GLAGRIN1 | |
| SCHEMBL4782065 | 0.87 | HDAC1 (0.37) | HDAC1ALDH1A1GRIN1GRIN2AHCAR3 | |
| SCHEMBL4023870 | 0.73 | HCAR3 (0.39) | HDAC1ALDH1A1GRIN1GRIN2AHCAR3 | |
| SCHEMBL15173773 | 0.70 | HCAR3 (0.38) | HDAC1HCAR3GRM1PTGIR | |
| SCHEMBL6027792 | 0.68 | ALDH1A1 (0.45) | TSHRALDH1A1GLA | |
| SCHEMBL26508794 | 0.68 | TDO2 (0.49) | — | |
| SCHEMBL19714338 | 0.67 | PTGIR (0.52) | HDAC1ALDH1A1PTGIR | |
| SCHEMBL6986725 | 0.67 | HCAR3 (0.36) | TSHRALDH1A1GLAHCAR3GBA1 | |
| SCHEMBL2453692 | 0.66 | HCAR3 (0.36) | HDAC1GRIN1GRIN2AHCAR3PTGIR | |
| SCHEMBL14547837 | 0.65 | TDO2 (0.36) | HDAC1GBA1 |
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-2010118078-A1 | MACROCYCLIC SERINE PROTEASE INHIBITORS | IDENIX PHARMACEUTICALS, INC. (US) | 2010-10-14 | — | — | WO | disclosed |