Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL6353876 | 0.90 | TSHR (0.52) | TSHRCYP3A4MAPK1TDP1AHR | |
| SCHEMBL11685824 | 0.90 | TSHR (0.52) | TSHRCYP3A4MAPK1TDP1ALDH1A1 | |
| SCHEMBL11226916 | 0.90 | TSHR (0.57) | TSHRCYP3A4MAPK1TDP1AHR | |
| SCHEMBL10493755 | 0.81 | CYP3A4 (0.44) | TSHRCYP3A4MAPK1TDP1LMNA | |
| SCHEMBL31092645 | 0.81 | TDP1 (0.44) | TSHRCYP3A4MAPK1TDP1ALDH1A1 | |
| SCHEMBL7555551 | 0.81 | TDP1 (0.44) | TSHRCYP3A4MAPK1TDP1ALDH1A1 | |
| SCHEMBL7057611 | 0.77 | TSHR (0.46) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL11602077 | 0.77 | CYP3A4 (0.46) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL16446376 | 0.75 | CYP3A4 (0.40) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL10493709 | 0.75 | CYP3A4 (0.44) | TSHRCYP3A4MAPK1TDP1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4163753-A | FROM AN ALIPHATIC ACID ANHYDRIDE AND A TRICHLOROMETHYL AROMATIC COMPOUND | Diaz Chemical Corporation (US) | 1979-08-07 | — | — | US | disclosed |