Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 3/20 | 0.62 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.51 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALPI | P09923 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | XIAP | P98170 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 2/20 | 0.42 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.42 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.42 |
| ▸ | PAM | P19021 | 1/20 | 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 | |
|---|---|---|---|---|
| Homoserine SCHEMBL6040192 | 1.00 | SLC7A5 (0.62) | SLC7A5CYP4F2CYP4A11TSHRALPI | |
| Homocysteine SCHEMBL6040082 | 0.87 | SLC7A5 (0.60) | SLC7A5CYP4F2CYP4A11TSHRALPI | |
| L-Homocysteine SCHEMBL6040083 | 0.87 | SLC7A5 (0.60) | SLC7A5CYP4F2CYP4A11TSHRALPI | |
| Alanine SCHEMBL6040106 | 0.86 | SLC7A5 (0.61) | SLC7A5CYP4F2CYP4A11TSHRALPI | |
| Alanine SCHEMBL6040105 | 0.86 | SLC7A5 (0.61) | SLC7A5CYP4F2CYP4A11TSHRALPI | |
| Glutamine SCHEMBL6040155 | 0.86 | SLC7A5 (0.59) | SLC7A5CYP4F2CYP4A11TSHRALPI | |
| Glutamine SCHEMBL6040157 | 0.86 | SLC7A5 (0.59) | SLC7A5CYP4F2CYP4A11TSHRALPI | |
| Phenylalanine SCHEMBL6040140 | 0.85 | SLC7A5 (0.78) | SLC7A5TSHRALPIPKMPTGS1 | |
| Dl-Phenylalanine SCHEMBL6040139 | 0.85 | SLC7A5 (0.78) | SLC7A5TSHRALPIPKMPTGS1 | |
| Methionine SCHEMBL6040042 | 0.85 | SLC7A5 (0.58) | SLC7A5TSHRALPIPKMPTGS1 |
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-1695088-A1 | METHOD FOR ANALYSING METABOLITES | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2006-08-30 | — | — | EP | disclosed |
| WO-2005059556-A1 | METHOD FOR ANALYSING METABOLITES | MAX PLANCK GESELLLSCHAFT ZUR FÖRDERUNG DER WISSENSCHAFTEN E.V. (DE) | 2005-06-30 | — | — | WO | disclosed |