Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 7/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 7/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13021429 | 0.88 | NLRP3 (0.40) | SMN1; SMN2OPRD1OPRK1OPRM1 | |
| SCHEMBL13065163 | 0.88 | NLRP3 (0.40) | SMN1; SMN2OPRD1OPRK1OPRM1 | |
| SCHEMBL5115246 | 0.87 | OPRD1 (0.46) | OPRD1OPRK1OPRM1 | |
| SCHEMBL5115242 | 0.87 | OPRD1 (0.46) | OPRD1OPRK1OPRM1 | |
| SCHEMBL25469279 | 0.86 | ESR1 (0.46) | SMN1; SMN2OPRD1OPRK1OPRM1 | |
| Hydrochloric Acid SCHEMBL5775220 | 0.85 | OPRD1 (0.46) | OPRD1OPRK1OPRM1 | |
| Hydrochloric Acid SCHEMBL5775227 | 0.85 | OPRD1 (0.46) | OPRD1OPRK1OPRM1 | |
| SCHEMBL25469337 | 0.85 | OPRD1 (0.45) | OPRD1OPRK1OPRM1 | |
| SCHEMBL21096380 | 0.83 | OPRM1 (0.47) | OPRD1OPRK1OPRM1 | |
| SCHEMBL19861959 | 0.82 | OPRK1 (0.55) | OPRD1OPRK1OPRM1 |
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-110467539-B | Resolution method of 2,6-dimethyl tyrosine ester and application thereof | 浙江普洛家园药业有限公司 | 2023-01-06 | — | — | CN | disclosed |