Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL7232180 | 0.91 | ALDH1A1 (0.38) | TSHRALDH1A1SMN1; SMN2TDP1MEN1 | |
| SCHEMBL22592392 | 0.83 | SMN1; SMN2 (0.47) | TSHRALDH1A1SMN1; SMN2TDP1MAPK1 | |
| Ethylene Glycol SCHEMBL6525526 | 0.81 | ALDH1A1 (0.45) | TSHRALDH1A1SMN1; SMN2TDP1MAPK1 | |
| SCHEMBL13681581 | 0.81 | TSHR (0.40) | TSHRALDH1A1SMN1; SMN2TDP1MAPK1 | |
| SCHEMBL8191937 | 0.80 | TSHR (0.60) | TSHRALDH1A1SMN1; SMN2TDP1MEN1 | |
| SCHEMBL4976681 | 0.80 | TSHR (0.60) | TSHRALDH1A1SMN1; SMN2TDP1MEN1 | |
| SCHEMBL8198631 | 0.80 | TSHR (0.60) | TSHRALDH1A1SMN1; SMN2TDP1MEN1 | |
| Triethylene Glycol SCHEMBL17007808 | 0.80 | TSHR (0.54) | TSHRALDH1A1SMN1; SMN2TDP1MEN1 | |
| SCHEMBL29212545 | 0.80 | TSHR (0.60) | TSHRALDH1A1SMN1; SMN2TDP1MEN1 | |
| SCHEMBL4608703 | 0.80 | TSHR (0.60) | TSHRALDH1A1SMN1; SMN2TDP1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016170015-A1 | EPOXY DERIVATIVES OF ION CHELATING LIGANDS, THEIR POLYMERIC CONJUGATES AND MEDICAL USES THEREOF | KOMPLEXIS S.R.L (IT) | 2016-10-27 | — | — | WO | disclosed |