Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.61 |
| ▸ | CES1 | P23141 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.42 |
| ▸ | CHRNG | P07510 | 1/20 | 0.42 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | CHRND | Q07001 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.41 |
| ▸ | KCNQ3 | O43525 | 2/20 | 0.40 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2273688 | 1.00 | CES2 (0.61) | CES2CES1KMT2ARAB9AMEN1 | |
| SCHEMBL30467135 | 0.83 | KCNQ3 (0.47) | CES2CES1KCNQ3KCNQ2KCNQ5 | |
| SCHEMBL6559766 | 0.83 | KCNQ3 (0.47) | CES2CES1KCNQ3KCNQ2KCNQ5 | |
| SCHEMBL28440957 | 0.83 | SNCA (0.50) | CES2CES1 | |
| SCHEMBL671907 | 0.83 | CES2 (0.61) | CES2CES1KMT2ARAB9AMEN1 | |
| SCHEMBL5253742 | 0.83 | CES2 (0.61) | CES2CES1KMT2ARAB9AMEN1 | |
| SCHEMBL21006684 | 0.82 | HDAC1 (0.58) | CES2CES1KMT2AKCNQ3KCNQ2 | |
| SCHEMBL28037289 | 0.82 | CES2 (0.41) | CES2CES1RAB9ANPC1MAOB | |
| SCHEMBL27503767 | 0.82 | KCNQ3 (0.44) | KMT2ARAB9AMEN1NPC1KCNQ3 | |
| SCHEMBL247898 | 0.81 | CES2 (0.59) | CES2CES1KMT2ARAB9AMEN1 |
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-115710158-A | Method for preparing ticagrelor intermediate through asymmetric catalysis | 凯特立斯（深圳）科技有限公司 | 2023-02-24 | — | — | CN | claimed |
| CN-115710158-A | Method for preparing ticagrelor intermediate through asymmetric catalysis | 凯特立斯（深圳）科技有限公司 | 2023-02-24 | — | — | CN | disclosed |
| CN-115710158-A | Method for preparing ticagrelor intermediate through asymmetric catalysis | 凯特立斯（深圳）科技有限公司 | 2023-02-24 | — | — | CN | disclosed |