Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 7/20 | 0.92 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.92 |
| ▸ | ALPI | P09923 | 1/20 | 0.92 |
| ▸ | PKM | P14618 | 1/20 | 0.92 |
| ▸ | XIAP | P98170 | 1/20 | 0.92 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.65 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.65 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.65 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.59 |
| ▸ | NOS3 | P29474 | 2/20 | 0.58 |
| ▸ | NOS1 | P29475 | 2/20 | 0.58 |
| ▸ | NOS2 | P35228 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | LTA4H | P09960 | 1/20 | 0.56 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | EGFR | P00533 | 1/20 | 0.55 |
| ▸ | LCK | P06239 | 1/20 | 0.55 |
| ▸ | FYN | P06241 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Phenylalanine SCHEMBL28570383 | 1.00 | SLC7A5 (0.92) | SLC7A5PTGS1ALPIPKMXIAP | |
| Dl-Phenylalanine SCHEMBL28298768 | 0.96 | SLC7A5 (0.92) | SLC7A5PTGS1ALPIPKMXIAP | |
| Phenylalanine SCHEMBL28298770 | 0.96 | SLC7A5 (0.92) | SLC7A5PTGS1ALPIPKMXIAP | |
| Phenylalanine SCHEMBL8609036 | 0.96 | SLC7A5 (0.92) | SLC7A5PTGS1ALPIPKMXIAP | |
| Dl-Phenylalanine SCHEMBL8609032 | 0.96 | SLC7A5 (0.92) | SLC7A5PTGS1ALPIPKMXIAP | |
| SCHEMBL23159186 | 0.96 | SLC7A5 (1.00) | SLC7A5PTGS1ALPIPKMXIAP | |
| Dl-Phenylalanine SCHEMBL1332173 | 0.96 | SLC7A5 (1.00) | SLC7A5PTGS1ALPIPKMXIAP | |
| Dl-Phenylalanine SCHEMBL1331205 | 0.96 | SLC7A5 (1.00) | SLC7A5PTGS1ALPIPKMXIAP | |
| Phenylalanine SCHEMBL1449128 | 0.96 | SLC7A5 (1.00) | SLC7A5PTGS1ALPIPKMXIAP | |
| Dl-Phenylalanine SCHEMBL2785094 | 0.96 | SLC7A5 (1.00) | SLC7A5PTGS1ALPIPKMXIAP |
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-112624955-B | Separation method of 3-indoloethyl (3 '-methyl-2' -ketone) valeramide | 西北农林科技大学 | 2024-07-09 | — | — | CN | disclosed |
| CN-112624955-A | Separation method of 3-indolylethyl (3 '-methyl-2' -ketone) valeramide | 西北农林科技大学 | 2021-04-09 | — | — | CN | disclosed |