Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA7 | P43166 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 2/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | CHAT | P28329 | 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 | |
|---|---|---|---|---|
| SCHEMBL672658 | 0.84 | CYP2A6 (0.43) | TSHRACHEALDH1A1HDAC8TP53 | |
| SCHEMBL27797387 | 0.82 | TSHR (0.39) | TSHRACHEALDH1A1TP53TDP1 | |
| SCHEMBL25964009 | 0.78 | TP53 (0.35) | TSHRACHEALDH1A1TP53TDP1 | |
| Iodobenzene SCHEMBL28041296 | 0.77 | ACHE (0.56) | TSHRACHEALDH1A1TDP1CYP2A6 | |
| Benzene SCHEMBL28149237 | 0.74 | ALDH1A1 (0.38) | TSHRACHEALDH1A1TP53TDP1 | |
| SCHEMBL1588208 | 0.73 | KDM4E (0.41) | TSHRALDH1A1TDP1CYP2A6CA1 | |
| SCHEMBL7921184 | 0.72 | ALDH1A1 (0.41) | TSHRACHEALDH1A1TP53TDP1 | |
| O-Xylene SCHEMBL16048907 | 0.71 | TSHR (0.62) | TSHRACHEALDH1A1TDP1CYP2A6 | |
| SCHEMBL41438 | 0.71 | ALDH1A1 (0.39) | TSHRACHEALDH1A1HDAC8TP53 | |
| SCHEMBL30332485 | 0.71 | ALDH1A1 (0.39) | TSHRACHEALDH1A1HDAC8TP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101686665-A | styrenyl derivative compounds for treating ophthalmic diseases and disorders | ACUCELA INC | 2010-03-31 | — | — | CN | disclosed |