Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | PGD | P52209 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27364734 | 0.97 | TSHR (0.56) | TSHRPGDHTTCYP2C9PDE4A | |
| SCHEMBL27623112 | 0.95 | TSHR (0.53) | TSHRPGDHTTCYP2C9PDE4A | |
| SCHEMBL22609753 | 0.92 | TSHR (0.50) | TSHRPGDHTTCYP2C9PDE4A | |
| SCHEMBL9862728 | 0.86 | TSHR (0.62) | TSHRPGDHTTCYP2C9PDE4A | |
| SCHEMBL1397720 | 0.86 | TSHR (0.62) | TSHRPGDHTTCYP2C9PDE4A | |
| SCHEMBL29232003 | 0.86 | TSHR (0.62) | TSHRPGDHTTCYP2C9PDE4A | |
| SCHEMBL14742965 | 0.83 | TSHR (0.59) | TSHRPGDHTTCYP2C9PDE4A | |
| SCHEMBL7992773 | 0.81 | TSHR (0.56) | TSHRPGDHTTCYP2C9PDE4A | |
| SCHEMBL9439905 | 0.81 | TSHR (0.56) | TSHRPGDHTTCYP2C9PDE4A | |
| SCHEMBL1580351 | 0.81 | TSHR (0.56) | TSHRPGDHTTCYP2C9PDE4A |
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 |
|---|---|---|---|---|---|---|---|
| US-4424091-A | METAL COMPOUND | DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) | 1984-01-03 | — | — | US | disclosed |
| US-4271224-A | A METAL COMPOUND CAUSES THE COLORING AGENT TO LOSE ITS HEAT TRANSFERIBILITY | DAI NIPPON INSATSU KABUSHIKI KAISHA (JP) | 1981-06-02 | — | — | US | disclosed |