Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 2/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL557653 | 0.95 | — | — | |
| Methyl Alcohol SCHEMBL27817336 | 0.91 | ALDH1A1 (0.40) | ALDH1A1TSHRNOS1HSD17B10KDM4E | |
| SCHEMBL267683 | 0.81 | — | — | |
| SCHEMBL3342146 | 0.81 | — | — | |
| SCHEMBL4489846 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL3508344 | 0.79 | — | — | |
| SCHEMBL12261831 | 0.77 | ALDH1A1 (0.41) | ALDH1A1TSHRNOS1HSD17B10KDM4E | |
| SCHEMBL27783363 | 0.77 | ALDH1A1 (0.55) | ALDH1A1TSHRKDM4ELMNAMAPKAPK2 | |
| SCHEMBL19267359 | 0.76 | — | — | |
| SCHEMBL21037832 | 0.76 | ALDH1A1 (0.39) | ALDH1A1TSHRNOS1HSD17B10KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108218808-A | A kind of preparation method of Ritonavir | 盐城迪赛诺制药有限公司 | 2018-06-29 | — | — | CN | disclosed |
| CN-1247554-C | Process for synthesizing ritonavir | UNIV XIAMEN (CN) | 2006-03-29 | — | — | CN | disclosed |