Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 3/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.37 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.34 |
| ▸ | GRM5 | P41594 | 3/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.33 |
| ▸ | FPR2 | P25090 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24608768 | 1.00 | HSD11B1 (0.43) | HSD11B1RIPK1GRIN1GRIN2AGRIN2B | |
| SCHEMBL29700945 | 1.00 | HSD11B1 (0.43) | HSD11B1RIPK1GRIN1GRIN2AGRIN2B | |
| SCHEMBL29700912 | 0.95 | HSD11B1 (0.44) | HSD11B1RIPK1GRIN1GRIN2AGRIN2B | |
| SCHEMBL26622789 | 0.95 | HSD11B1 (0.44) | HSD11B1RIPK1GRIN1GRIN2AGRIN2B | |
| SCHEMBL24608371 | 0.85 | RIPK1 (0.36) | HSD11B1RIPK1SLC6A2SLC6A4OPRM1 | |
| SCHEMBL29700904 | 0.85 | RIPK1 (0.36) | HSD11B1RIPK1SLC6A2SLC6A4OPRM1 | |
| SCHEMBL625206 | 0.84 | HSD11B1 (0.49) | HSD11B1RIPK1GRIN1GRIN2AGRIN2B | |
| SCHEMBL28800631 | 0.82 | HSD11B1 (0.39) | HSD11B1RIPK1GRIN1GRIN2AGRIN2B | |
| SCHEMBL26622783 | 0.80 | NPC1 (0.43) | HSD11B1RIPK1ALDH1A1HTTITGA4 | |
| SCHEMBL28800675 | 0.76 | HSD11B1 (0.40) | HSD11B1RIPK1ALDH1A1OPRM1OPRL1 |
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-114685363-A | ROR gamma t regulator, preparation method and application thereof | 上海医药集团股份有限公司 | 2022-07-01 | — | — | CN | disclosed |