Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.69 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.43 |
| ▸ | ACHE | P22303 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29107033 | 1.00 | TSHR (0.69) | TSHRTHRBSLC22A1ACHEALDH1A1 | |
| SCHEMBL29107070 | 1.00 | TSHR (0.69) | TSHRTHRBSLC22A1ACHEALDH1A1 | |
| SCHEMBL29107018 | 1.00 | TSHR (0.69) | TSHRTHRBSLC22A1ACHEALDH1A1 | |
| SCHEMBL29106996 | 1.00 | TSHR (0.69) | TSHRTHRBSLC22A1ACHEALDH1A1 | |
| SCHEMBL26571676 | 1.00 | TSHR (0.69) | TSHRTHRBSLC22A1ACHEALDH1A1 | |
| SCHEMBL9278057 | 0.98 | TSHR (0.71) | TSHRTHRBSLC22A1ACHEALDH1A1 | |
| SCHEMBL2744512 | 0.98 | TSHR (0.71) | TSHRTHRBSLC22A1ACHEALDH1A1 | |
| SCHEMBL2745020 | 0.97 | TSHR (0.68) | TSHRTHRBSLC22A1ACHEALDH1A1 | |
| SCHEMBL2744210 | 0.94 | TSHR (0.65) | TSHRTHRBSLC22A1ACHEALDH1A1 | |
| Hydrochloric Acid SCHEMBL28582384 | 0.94 | TSHR (0.65) | TSHRTHRBSLC22A1ACHEALDH1A1 |
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-117043136-A | Fluorine-based ionic liquid and method for producing same | 第一工业制药株式会社 | 2023-11-10 | — | — | CN | disclosed |