Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | ATR | Q13535 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | AOC1 | P19801 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL451238 | 0.94 | — | — | |
| SCHEMBL27509881 | 0.94 | — | — | |
| SCHEMBL8014988 | 0.94 | TSHR (0.56) | TSHRATMATRALDH1A1HSD17B10 | |
| SCHEMBL7198648 | 0.94 | TSHR (0.56) | TSHRATMATRALDH1A1HSD17B10 | |
| SCHEMBL1866989 | 0.94 | — | — | |
| SCHEMBL27856367 | 0.94 | — | — | |
| Methane SCHEMBL1900735 | 0.89 | TSHR (0.50) | TSHRATMATRALDH1A1HSD17B10 | |
| Water SCHEMBL29156411 | 0.89 | TSHR (0.50) | TSHRATMATRALDH1A1HSD17B10 | |
| Methane SCHEMBL1442993 | 0.89 | TSHR (0.50) | TSHRATMATRALDH1A1HSD17B10 | |
| Methane SCHEMBL11037799 | 0.89 | TSHR (0.50) | TSHRATMATRALDH1A1HSD17B10 |
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-4336025-A | DISPERSE OR VAT DYES AND WATER SOLUBLE NONIONIC SURFACTANTS | HOECHST AKTIENGESELLSCHAFT (DE) | 1982-06-22 | — | — | US | disclosed |