Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 5/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | MGLL | Q99685 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.39 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.39 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.39 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.39 |
| ▸ | LPL | P06858 | 1/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL128893 | 0.97 | ENPP2 (0.46) | ENPP2CA2CA1MGLLCES2 | |
| SCHEMBL1158717 | 0.87 | ENPP2 (0.38) | ENPP2CA2CA1MGLLCES2 | |
| SCHEMBL974659 | 0.82 | TRPV6 (0.52) | ENPP2CES2CES1ORAI1ORAI2 | |
| SCHEMBL15810345 | 0.79 | CA2 (0.52) | ENPP2CA2CA1MGLLTSHR | |
| SCHEMBL309397 | 0.78 | CA3 (0.52) | ENPP2CA2CA1MGLLTTR | |
| SCHEMBL22207451 | 0.78 | ENPP2 (0.42) | ENPP2CA2CA1MGLLTTR | |
| SCHEMBL29954381 | 0.78 | CA3 (0.52) | ENPP2CA2CA1MGLLTTR | |
| SCHEMBL14459947 | 0.78 | CES2 (0.38) | ENPP2CA2CES2CES1ORAI1 | |
| SCHEMBL423468 | 0.78 | ENPP2 (0.44) | ENPP2CA2CA1MGLLTTR | |
| SCHEMBL15646351 | 0.78 | CA2 (0.42) | ENPP2CA2CA1MGLLTTR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107827755-B | Synthesis method of ticagrelor intermediate (1R,2S) -2- (3, 4-difluorophenyl) cyclopropylamine | 诚达药业股份有限公司 | 2020-11-24 | — | — | CN | claimed |
| CN-107827755-B | Synthesis method of ticagrelor intermediate (1R,2S) -2- (3, 4-difluorophenyl) cyclopropylamine | 诚达药业股份有限公司 | 2020-11-24 | — | — | CN | disclosed |