Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | GRM8 | O00222 | 1/20 | 0.36 |
| ▸ | GRM6 | O15303 | 1/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.33 |
| ▸ | MME | P08473 | 1/20 | 0.32 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL12285406 | 1.00 | CES2 (0.41) | CES2CES1ALDH1A1ADRB1ADRA2A | |
| SCHEMBL30371878 | 1.00 | CES2 (0.41) | CES2CES1ALDH1A1ADRB1ADRA2A | |
| SCHEMBL2557213 | 1.00 | CES2 (0.41) | CES2CES1ALDH1A1ADRB1ADRA2A | |
| SCHEMBL30372083 | 1.00 | CES2 (0.41) | CES2CES1ALDH1A1ADRB1ADRA2A | |
| SCHEMBL14910192 | 0.81 | CES2 (0.35) | CES2CES1ALDH1A1GRM8GRM6 | |
| SCHEMBL12286385 | 0.81 | PDPK1 (0.38) | CES2CES1ALDH1A1AKR1C3AKR1C2 | |
| SCHEMBL14923622 | 0.81 | CES2 (0.35) | CES2CES1ALDH1A1GRM8GRM6 | |
| SCHEMBL28980525 | 0.76 | SIGMAR1 (0.36) | CES2CES1ALDH1A1GRM8GRM6 | |
| SCHEMBL28980526 | 0.76 | SIGMAR1 (0.36) | CES2CES1ALDH1A1GRM8GRM6 | |
| SCHEMBL24370650 | 0.75 | CES2 (0.44) | CES2CES1ADRB1ADRA2AADRB3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2589587-A1 | Synthesis of nitrogen substituted cyclopropanes | Chemo Ibérica, S.A. (ES) | 2013-05-08 | — | — | EP | claimed |
| CN-115894496-B | Preparation method of ticagrelor and intermediate thereof | 上海贝美医药科技有限公司 | 2025-03-21 | — | — | CN | disclosed |
| CN-115894496-A | Preparation method of ticagrelor and intermediate thereof | 上海贝美医药科技有限公司 | 2023-04-04 | — | — | CN | disclosed |
| EP-2589587-A1 | Synthesis of nitrogen substituted cyclopropanes | Chemo Ibérica, S.A. (ES) | 2013-05-08 | — | — | EP | disclosed |
| EP-2589587-A1 | Synthesis of nitrogen substituted cyclopropanes | Chemo Ibérica, S.A. (ES) | 2013-05-08 | — | — | EP | disclosed |