Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | AGXT | P21549 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CHKA | P35790 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3539199 | 0.87 | IDO1 (0.42) | TSHRALDH1A1IDO1MAPTAGXT | |
| SCHEMBL1674458 | 0.79 | TSHR (0.52) | TSHRALDH1A1IDO1MAPTHPGD | |
| SCHEMBL24632162 | 0.79 | TSHR (0.52) | TSHRALDH1A1IDO1MAPTHPGD | |
| Hydrochloric Acid SCHEMBL28441325 | 0.78 | AGXT (0.46) | TSHRALDH1A1IDO1MAPTHPGD | |
| SCHEMBL9320965 | 0.77 | MEN1 (0.39) | TSHRALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL24045838 | 0.76 | AOC3 (0.52) | IDO1ALOX5AOC3SIGMAR1 | |
| SCHEMBL10063510 | 0.75 | TSHR (0.52) | TSHRALDH1A1IDO1AGXTALOX5 | |
| SCHEMBL1577188 | 0.74 | TSHR (0.46) | TSHRALDH1A1IDO1MAPTHPGD | |
| SCHEMBL4944239 | 0.74 | IDO1 (0.48) | TSHRALDH1A1IDO1MAPTAGXT | |
| SCHEMBL14617699 | 0.74 | TSHR (0.46) | TSHRALDH1A1IDO1MAPTHPGD |
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-2019196262-A1 | PREPARATION METHOD FOR HEXAHYDROFURO-FURAN-OL DERIVATIVE, AND INTERMEDIATE OF DERIVATIVE AND PREPARATION METHOD THEREFOR | 江苏瑞科医药科技有限公司 | 2019-10-17 | — | — | WO | disclosed |