Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.42 |
| ▸ | NOS2 | P35228 | 2/20 | 0.42 |
| ▸ | GABRP | O00591 | 3/20 | 0.38 |
| ▸ | GABRD | O14764 | 3/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.38 |
| ▸ | GABRA4 | P48169 | 3/20 | 0.38 |
| ▸ | GABRE | P78334 | 3/20 | 0.38 |
| ▸ | GABRA6 | Q16445 | 3/20 | 0.38 |
| ▸ | GABRG1 | Q8N1C3 | 3/20 | 0.38 |
| ▸ | GABRG3 | Q99928 | 3/20 | 0.38 |
| ▸ | GABRQ | Q9UN88 | 3/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24899829 | 0.77 | — | — | |
| SCHEMBL24899681 | 0.77 | FDFT1 (0.38) | — | |
| SCHEMBL1712299 | 0.77 | TDP1 (0.39) | NOS3NOS2GABRPGABRDGABRA1 | |
| SCHEMBL1711802 | 0.75 | HDAC1 (0.37) | NOS3NOS2GABRPGABRDGABRA1 | |
| SCHEMBL2033420 | 0.73 | GAA (0.40) | SMN1; SMN2KDM4ECYP1A2 | |
| SCHEMBL28940796 | 0.69 | — | — | |
| SCHEMBL26699649 | 0.65 | PSIP1 (0.45) | NOS3NOS2HDAC6SMN1; SMN2KDM4E | |
| SCHEMBL24899665 | 0.64 | KCNA5 (0.39) | — | |
| SCHEMBL24899753 | 0.64 | GAA (0.31) | — | |
| SCHEMBL312816 | 0.64 | — | — |
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-113666877-B | TYK2 inhibitor compound containing alkoxy and amide | 正大天晴药业集团股份有限公司 | 2024-12-10 | — | — | CN | disclosed |