Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 8/20 | 0.57 |
| ▸ | NOS3 | P29474 | 3/20 | 0.57 |
| ▸ | NOS1 | P29475 | 3/20 | 0.57 |
| ▸ | NOS2 | P35228 | 3/20 | 0.57 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.57 |
| ▸ | ALPI | P09923 | 1/20 | 0.57 |
| ▸ | PKM | P14618 | 1/20 | 0.57 |
| ▸ | XIAP | P98170 | 1/20 | 0.57 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | LCK | P06239 | 1/20 | 0.50 |
| ▸ | FYN | P06241 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL15441968 | 1.00 | SLC7A5 (0.57) | SLC7A5NOS3NOS1NOS2PTGS1 | |
| SCHEMBL15441969 | 1.00 | SLC7A5 (0.57) | SLC7A5NOS3NOS1NOS2PTGS1 | |
| Hydrochloric Acid SCHEMBL20703400 | 0.98 | NOS3 (0.56) | SLC7A5NOS3NOS1NOS2PTGS1 | |
| Hydrochloric Acid SCHEMBL30999653 | 0.98 | NOS3 (0.56) | SLC7A5NOS3NOS1NOS2PTGS1 | |
| Hydrochloric Acid SCHEMBL20680181 | 0.98 | NOS3 (0.56) | SLC7A5NOS3NOS1NOS2PTGS1 | |
| SCHEMBL15445330 | 0.89 | ALDH1A1 (0.46) | SLC7A5NOS3NOS1NOS2PTGS1 | |
| SCHEMBL8823287 | 0.87 | ALDH1A1 (0.44) | SLC7A5NOS3NOS1NOS2PTGS1 | |
| SCHEMBL1984332 | 0.86 | SLC7A5 (0.59) | SLC7A5NOS3NOS1NOS2PTGS1 | |
| SCHEMBL1984335 | 0.86 | SLC7A5 (0.59) | SLC7A5NOS3NOS1NOS2PTGS1 | |
| SCHEMBL3152493 | 0.86 | SLC7A5 (0.59) | SLC7A5NOS3NOS1NOS2PTGS1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118684605-A | Preparation of ritgasan Process for the preparation of intermediates | 山东新时代药业有限公司 | 2024-09-24 | — | — | CN | disclosed |
| CN-118420572-A | Synthesis method of medicine intermediate benzofuran-6-carboxylic acid | 山东新时代药业有限公司 | 2024-08-02 | — | — | CN | disclosed |
| CN-118420531-A | Preparation method of ritalst intermediate | 山东新时代药业有限公司 | 2024-08-02 | — | — | CN | disclosed |
| CN-118420573-A | Preparation method of litaxetil intermediate benzofuran-6-carboxylic acid | 山东新时代药业有限公司 | 2024-08-02 | — | — | CN | disclosed |