Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 3/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29226640 | 0.76 | OPRD1 (0.35) | OPRD1CYP2D6OPRM1OPRK1OPRL1 | |
| SCHEMBL4492789 | 0.74 | ESR2 (0.52) | OPRD1ESR1ESR2KDM4EALDH1A1 | |
| SCHEMBL25553798 | 0.71 | ALDH1A1 (0.47) | OPRD1ESR1ESR2ALDH1A1OPRM1 | |
| SCHEMBL5241008 | 0.70 | ESR2 (0.60) | OPRD1ESR1ESR2KDM4EALDH1A1 | |
| SCHEMBL1495106 | 0.70 | ESR2 (0.54) | OPRD1ESR1ESR2KDM4EALDH1A1 | |
| SCHEMBL25553800 | 0.70 | USP2 (0.44) | OPRD1CYP2D6ESR1ALDH1A1GRM5 | |
| SCHEMBL25560262 | 0.70 | OPRD1 (0.46) | OPRD1ESR1ESR2GRM5OPRM1 | |
| SCHEMBL1516123 | 0.69 | ESR2 (0.61) | OPRD1ESR1ESR2KDM4EALDH1A1 | |
| SCHEMBL29226884 | 0.69 | GRM3 (0.30) | — | |
| SCHEMBL25026045 | 0.69 | ESR1 (0.43) | OPRD1ESR1ESR2GRM5 |
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-118119595-A | Compounds and compositions for the treatment of diseases associated with STING activity | 艾福姆德尤股份有限公司 | 2024-05-31 | — | — | CN | disclosed |