Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ALPI | P09923 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | XIAP | P98170 | 1/20 | 0.40 |
| ▸ | SLC1A3 | P43003 | 3/20 | 0.39 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.39 |
| ▸ | SLC1A1 | P43005 | 3/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 3/20 | 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 | |
|---|---|---|---|---|
| Asparagine SCHEMBL15670521 | 1.00 | CYP2C19 (0.50) | CYP2C19KDM4EHIF1ATDP1PKM | |
| Aspartic Acid SCHEMBL15670472 | 0.89 | MIF (0.43) | CYP2C19KDM4EHIF1ATDP1PKM | |
| Aspartic Acid SCHEMBL15670468 | 0.89 | MIF (0.43) | CYP2C19KDM4EHIF1ATDP1PKM | |
| Glutamine SCHEMBL15670856 | 0.84 | KMT2A (0.58) | CYP2C19PKMSLC7A5POLBPTPN1 | |
| Glutamine SCHEMBL15670853 | 0.84 | KMT2A (0.58) | CYP2C19PKMSLC7A5POLBPTPN1 | |
| Cysteine SCHEMBL15670419 | 0.83 | PTGS1 (0.55) | CYP2C19KDM4EHIF1ATDP1PKM | |
| Serine SCHEMBL15670511 | 0.83 | SLC7A5 (0.42) | CYP2C19KDM4EHIF1ATDP1PKM | |
| Cysteine SCHEMBL15670416 | 0.83 | PTGS1 (0.55) | CYP2C19KDM4EHIF1ATDP1PKM | |
| Serine SCHEMBL15670508 | 0.83 | SLC7A5 (0.42) | CYP2C19KDM4EHIF1ATDP1PKM | |
| Leucine SCHEMBL15670430 | 0.83 | SLC7A5 (0.56) | PKMSLC7A5POLBPTPN1PTPN7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2914131-A1 | FLAVOUR ADDITIVES | Mars, Incorporated (US) | 2015-09-09 | — | — | EP | disclosed |
| WO-2014068044-A1 | FLAVOUR ADDITIVES | MARS, INCORPORATED (US) | 2014-05-08 | — | — | WO | disclosed |