Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL312084 | 0.81 | CES1 (0.50) | CES1CYP3A4MAPTALOX15MEN1 | |
| SCHEMBL8932431 | 0.81 | ALDH1A1 (0.56) | CYP3A4KMT2ATDP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL168007 | 0.81 | CES1 (0.55) | CES1CYP3A4MAPTALOX15MEN1 | |
| Hydrochloric Acid SCHEMBL28496848 | 0.79 | CES1 (0.52) | CES1CYP3A4MAPTALOX15MEN1 | |
| Water SCHEMBL27612226 | 0.79 | CES1 (0.52) | CES1CYP3A4MAPTALOX15MEN1 | |
| Hydrogen Sulfide SCHEMBL28111724 | 0.79 | CES1 (0.52) | CES1CYP3A4MAPTALOX15MEN1 | |
| SCHEMBL11742945 | 0.73 | CES1 (0.46) | CES1CYP3A4MAPTALOX15MEN1 | |
| SCHEMBL8494639 | 0.73 | CA2 (0.48) | CES1CYP3A4MAPTALOX15MEN1 | |
| SCHEMBL5031044 | 0.73 | KMT2A (0.47) | CES1CYP3A4MAPTALOX15MEN1 | |
| SCHEMBL11623306 | 0.71 | CES1 (0.48) | CES1CYP3A4MAPTALOX15MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996026939-A1 | CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-06 | — | — | WO | disclosed |