Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY1 | P47900 | 7/20 | 0.84 |
| ▸ | P2RY2 | P41231 | 4/20 | 0.84 |
| ▸ | P2RX1 | P51575 | 4/20 | 0.84 |
| ▸ | P2RX3 | P56373 | 4/20 | 0.84 |
| ▸ | SRC | P12931 | 2/20 | 0.84 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.84 |
| ▸ | P2RX2 | Q9UBL9 | 2/20 | 0.84 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.84 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.84 |
| ▸ | TRPM2 | O94759 | 2/20 | 0.80 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.80 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.80 |
| ▸ | DNPH1 | O43598 | 1/20 | 0.80 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.80 |
| ▸ | LDHA | P00338 | 1/20 | 0.80 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.80 |
| ▸ | FBP1 | P09467 | 1/20 | 0.80 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.80 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.80 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.80 |
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 | |
|---|---|---|---|---|
| SCHEMBL6242721 | 1.00 | P2RY1 (0.84) | P2RY1P2RY2P2RX1P2RX3SRC | |
| SCHEMBL28367704 | 1.00 | P2RY1 (0.84) | P2RY1P2RY2P2RX1P2RX3SRC | |
| SCHEMBL29001533 | 0.99 | P2RY1 (0.82) | P2RY1P2RY2P2RX1P2RX3SRC | |
| SCHEMBL28755762 | 0.99 | P2RY1 (0.82) | P2RY1P2RY2P2RX1P2RX3SRC | |
| SCHEMBL28397749 | 0.98 | P2RY1 (0.84) | P2RY1P2RY2P2RX1P2RX3SRC | |
| SCHEMBL459771 | 0.98 | P2RY1 (0.84) | P2RY1P2RY2P2RX1P2RX3SRC | |
| SCHEMBL459997 | 0.98 | P2RY1 (0.84) | P2RY1P2RY2P2RX1P2RX3SRC | |
| SCHEMBL2321068 | 0.98 | P2RY1 (0.81) | P2RY1P2RY2P2RX1P2RX3SRC | |
| SCHEMBL1746647 | 0.98 | P2RY1 (0.84) | P2RY1P2RY2P2RX1P2RX3SRC | |
| SCHEMBL28210249 | 0.98 | P2RY1 (0.81) | P2RY1P2RY2P2RX1P2RX3SRC |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109517813-B | Creatine kinase and isozyme activator, determination reagent and kit thereof | 东软威特曼生物科技(南京)有限公司 | 2022-04-12 | — | — | CN | disclosed |
| CN-113624862-A | Metabolome covering multiple metabolites, metabolic flux analysis method and kit | 清华大学 | 2021-11-09 | — | — | CN | disclosed |
| CN-109517879-B | Creatine kinase and isoenzyme determination reagent and kit thereof | 东软威特曼生物科技(南京)有限公司 | 2021-09-10 | — | — | CN | disclosed |