Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.51 |
| ▸ | FAAH | O00519 | 8/20 | 0.46 |
| ▸ | CES1 | P23141 | 6/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL29185048 | 0.90 | FAAH (0.50) | CES2FAAHCES1MEN1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL4450230 | 0.88 | FAAH (0.48) | CES2FAAHCES1MEN1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL29225076 | 0.86 | CES2 (0.66) | CES2FAAHCES1MEN1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL28053749 | 0.82 | CES2 (0.55) | CES2FAAHCES1MEN1CYP1A2 | |
| Tetrahydrofuran SCHEMBL1322236 | 0.80 | TSHR (0.48) | CES2MEN1CYP1A2KMT2ALMNA | |
| Tetrahydrofuran SCHEMBL8587992 | 0.80 | HTT (0.48) | CES2CES1MEN1KMT2ASMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL28538609 | 0.79 | ALDH1A1 (0.35) | CES2FAAHCES1MEN1CYP1A2 | |
| Tetrahydrofuran SCHEMBL6911585 | 0.78 | HTT (0.52) | CES2CES1MEN1KMT2ASMN1; SMN2 | |
| Tetrahydrofuran SCHEMBL11352874 | 0.78 | HTT (0.52) | CES2CES1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL6819723 | 0.78 | TSHR (0.46) | CES2MEN1CYP1A2KMT2ALMNA |
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-113945672-B | Method for detecting ticagrelor and related substances thereof | 武汉武药科技有限公司 | 2024-03-12 | — | — | CN | disclosed |