Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 3/20 | 0.62 |
| ▸ | NOS1 | P29475 | 3/20 | 0.62 |
| ▸ | NOS2 | P35228 | 3/20 | 0.62 |
| ▸ | GABRP | O00591 | 3/20 | 0.50 |
| ▸ | GABRD | O14764 | 3/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.50 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.50 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.50 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.50 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.50 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.50 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.50 |
| ▸ | GABRA4 | P48169 | 3/20 | 0.50 |
| ▸ | GABRE | P78334 | 3/20 | 0.50 |
| ▸ | GABRA6 | Q16445 | 3/20 | 0.50 |
| ▸ | GABRG1 | Q8N1C3 | 3/20 | 0.50 |
| ▸ | GABRG3 | Q99928 | 3/20 | 0.50 |
| ▸ | GABRQ | Q9UN88 | 3/20 | 0.50 |
| ▸ | FEN1 | P39748 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21649400 | 0.81 | GABRP (0.54) | NOS3NOS1NOS2GABRPGABRD | |
| SCHEMBL24595030 | 0.78 | NOS3 (0.41) | NOS3NOS1NOS2GABRPGABRD | |
| SCHEMBL24506838 | 0.78 | NOS3 (0.67) | NOS3NOS1NOS2GABRPGABRD | |
| SCHEMBL8322579 | 0.77 | NOS3 (1.00) | NOS3NOS1NOS2GABRPGABRD | |
| SCHEMBL26453049 | 0.75 | NOS3 (0.38) | NOS3NOS1NOS2GABRPGABRD | |
| SCHEMBL23279739 | 0.75 | NOS3 (0.62) | NOS3NOS1NOS2GABRPGABRD | |
| SCHEMBL91485 | 0.75 | NOS3 (0.56) | NOS3NOS1NOS2GABRPGABRD | |
| SCHEMBL10400011 | 0.74 | NOS3 (0.61) | NOS3NOS1NOS2GABRPGABRD | |
| SCHEMBL24959359 | 0.73 | SIRT6 (0.40) | NOS3NOS1NOS2GABRPGABRD | |
| SCHEMBL18031196 | 0.72 | NOS3 (0.70) | NOS3NOS1NOS2GABRPGABRD |
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 |
|---|---|---|---|---|---|---|---|
| CN-118434744-A | Nitrogen-containing macrocyclic compound, and preparation method and medical application thereof | 中国医药研究开发中心有限公司 | 2024-08-02 | — | — | CN | disclosed |