Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 7/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | HPRT1 | P00492 | 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 | |
|---|---|---|---|---|
| SCHEMBL52125 | 0.89 | TSHR (0.44) | CYP2A6ALOX12TDP1TSHRACHE | |
| Water SCHEMBL6913191 | 0.86 | TSHR (0.41) | CYP2A6ALOX12TDP1TSHRACHE | |
| Ammonia Solution, Strong SCHEMBL11868999 | 0.86 | TSHR (0.41) | CYP2A6ALOX12TDP1TSHRACHE | |
| Hydrochloric Acid SCHEMBL312008 | 0.86 | TSHR (0.41) | CYP2A6ALOX12TDP1TSHRACHE | |
| SCHEMBL3133054 | 0.86 | TSHR (0.41) | ALOX12TDP1TSHRACHELMNA | |
| Fluoride SCHEMBL704196 | 0.86 | TSHR (0.41) | CYP2A6ALOX12TDP1TSHRACHE | |
| Hydrochloric Acid SCHEMBL15122374 | 0.86 | TSHR (0.41) | CYP2A6ALOX12TDP1TSHRACHE | |
| SCHEMBL2793385 | 0.86 | TSHR (0.41) | CYP2A6ALOX12TDP1TSHRACHE | |
| SCHEMBL2793388 | 0.86 | TSHR (0.41) | CYP2A6ALOX12TDP1TSHRACHE | |
| Hydrochloric Acid SCHEMBL5702857 | 0.86 | TSHR (0.41) | CYP2A6ALOX12TDP1TSHRACHE |
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-117660992-A | Synthesis method of organosilicon compound containing Si-O bond | 新疆大学 | 2024-03-08 | — | — | CN | disclosed |