Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11266506 | 0.82 | GAA (0.47) | HTTSIGMAR1GAAL3MBTL1LMNA | |
| SCHEMBL11769649 | 0.75 | TSHR (0.38) | TSHRHTTAKR1B1GAAL3MBTL1 | |
| SCHEMBL11768890 | 0.75 | TSHR (0.38) | TSHRHTTAKR1B1GAAL3MBTL1 | |
| SCHEMBL6552912 | 0.75 | TAAR1 (0.61) | TSHRL3MBTL1LMNA | |
| SCHEMBL3875424 | 0.75 | SIGMAR1 (0.41) | TSHRHTTAKR1B1SIGMAR1L3MBTL1 | |
| SCHEMBL11674029 | 0.74 | HTT (0.42) | TSHRHTTAKR1B1LMNA | |
| SCHEMBL809019 | 0.74 | KDM5A (0.52) | TSHRSIGMAR1CYP3A4CYP2D6 | |
| SCHEMBL3706515 | 0.73 | DGAT1 (0.45) | TSHRHTTHCAR2LMNA | |
| SCHEMBL11247838 | 0.73 | SIGMAR1 (0.41) | SIGMAR1LMNA | |
| SCHEMBL11248782 | 0.72 | SIGMAR1 (0.36) | SIGMAR1LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008138084-A2 | PROCESS FOR ENRICHMENT OF SAFROLE | UNIVERSIDADE ESTADUAL DE CAMPINAS-UNICAMP (BR) | 2008-11-20 | — | — | WO | disclosed |
| US-4036842-A | FRIEDEL CRAFTS CATALYST | AMERICAN HOME PRODUCTS CORPORATION (US) | 1977-07-19 | — | — | US | disclosed |
| US-4021451-A | P-(3,4-DIHYDRO-1-METHYL-1H-(1)BENZOTHIENO(2,3-C)PYRAN-1-YL)PHENYL) -ACETIC ACID | AMERICAN HOME PRODUCTS CORPORATION (US) | 1977-05-03 | — | — | US | disclosed |