Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CTSG | P08311 | 4/20 | 0.40 |
| ▸ | CTRB1 | P17538 | 4/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.40 |
| ▸ | CMA1 | P23946 | 3/20 | 0.40 |
| ▸ | AKT1 | P31749 | 2/20 | 0.40 |
| ▸ | CES1 | P23141 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 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 | |
|---|---|---|---|---|
| SCHEMBL5164177 | 0.80 | TSHR (0.55) | TSHRCTSGCTRB1PRSS1CMA1 | |
| SCHEMBL9848566 | 0.80 | ELANE (0.46) | TSHRAKT1CES1KMT2AMEN1 | |
| SCHEMBL29180078 | 0.80 | ELANE (0.46) | TSHRAKT1CES1KMT2AMEN1 | |
| SCHEMBL9848557 | 0.80 | ELANE (0.46) | TSHRAKT1CES1KMT2AMEN1 | |
| SCHEMBL7132464 | 0.77 | TSHR (0.45) | TSHRMTNR1AMTNR1BAKT1CES1 | |
| SCHEMBL29006131 | 0.76 | TSHR (0.54) | TSHRCES1KMT2AMAPTMAPK1 | |
| SCHEMBL28377197 | 0.71 | LMNA (0.63) | TSHRCES1KMT2AMEN1MAPT | |
| SCHEMBL28145298 | 0.71 | KMT2A (0.70) | CES1KMT2AMEN1MAPTHPGD | |
| SCHEMBL27141305 | 0.71 | KMT2A (0.70) | CES1KMT2AMEN1MAPTHPGD | |
| SCHEMBL29273755 | 0.71 | ALDH1A1 (0.47) | TSHRCES1KMT2AMEN1MAPT |
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-104744325-B | A kind of Alpha-hydroxy thioether and preparation method and application | 中国人民大学 | 2016-08-17 | — | — | CN | disclosed |