Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24263523 | 1.00 | NPSR1 (0.43) | NPSR1NOS3NOS1NOS2KMT2A | |
| SCHEMBL29754529 | 0.81 | TYK2 (0.41) | ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL16794648 | 0.81 | TYK2 (0.41) | ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL20689667 | 0.78 | KMT2A (0.38) | NOS3NOS1NOS2KMT2AMEN1 | |
| SCHEMBL16812420 | 0.76 | RPS6KA5 (0.39) | NOS3NOS1NOS2KMT2AALDH1A1 | |
| SCHEMBL20689406 | 0.74 | TYK2 (0.38) | KMT2AMEN1MAPTUSP2RECQL | |
| SCHEMBL29728418 | 0.73 | ALDH1A1 (0.46) | NPSR1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL28802572 | 0.73 | ALDH1A1 (0.46) | NPSR1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL16794606 | 0.72 | CHEK1 (0.44) | ALDH1A1POLBHTT | |
| SCHEMBL29754377 | 0.72 | CHEK1 (0.44) | ALDH1A1POLBHTT |
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-115916207-A | Five-membered and six-membered heterocyclic compounds and application thereof as protein receptor kinase inhibitors | 轶诺(浙江)药业有限公司 | 2023-04-04 | — | — | CN | disclosed |