Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 6/20 | 0.33 |
| ▸ | CES1 | P23141 | 5/20 | 0.33 |
| ▸ | FAAH | O00519 | 2/20 | 0.32 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.31 |
| ▸ | GMNN | O75496 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL9936985 | 0.82 | TSHR (0.52) | TSHRCES2CES1FOLH1GMNN | |
| SCHEMBL722984 | 0.74 | TSHR (0.59) | TSHRCES2CES1GMNNTP53 | |
| SCHEMBL9938116 | 0.73 | TSHR (0.39) | TSHRCES2CES1HSD17B10 | |
| SCHEMBL8728123 | 0.72 | TSHR (0.42) | TSHRCES2CES1FAAHGMNN | |
| SCHEMBL25996465 | 0.71 | TSHR (0.60) | TSHRCES2CES1FAAHGMNN | |
| SCHEMBL4645637 | 0.70 | — | — | |
| SCHEMBL9709138 | 0.69 | ALDH1A1 (0.42) | TSHRCES2CES1FAAHGMNN | |
| SCHEMBL723055 | 0.69 | FOLH1 (0.42) | TSHRCES2CES1FOLH1 | |
| SCHEMBL7452799 | 0.69 | TSHR (0.58) | TSHRCES2CES1FAAHGMNN | |
| SCHEMBL28523083 | 0.69 | CES2 (0.68) | TSHRCES2CES1FAAHHSD17B10 |
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-2012081712-A1 | PROCESS FOR THE PREPARATION OF HYDROXYCARBOXYLIC ACID COMPOUND OR SALT THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-06-21 | — | — | WO | disclosed |