Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 9/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 8/20 | 0.53 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.53 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.53 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.53 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.53 |
| ▸ | PAK4 | O96013 | 1/20 | 0.53 |
| ▸ | PRKCG | P05129 | 1/20 | 0.53 |
| ▸ | CDK1 | P06493 | 1/20 | 0.53 |
| ▸ | PRKACA | P17612 | 1/20 | 0.53 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.53 |
| ▸ | CDK2 | P24941 | 1/20 | 0.53 |
| ▸ | AKT1 | P31749 | 1/20 | 0.53 |
| ▸ | AKT2 | P31751 | 1/20 | 0.53 |
| ▸ | CLK2 | P49760 | 1/20 | 0.53 |
| ▸ | GSK3A | P49840 | 1/20 | 0.53 |
| ▸ | GSK3B | P49841 | 1/20 | 0.53 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.53 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.53 |
| ▸ | PRKX | P51817 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL30040837 | 0.80 | TACR3 (0.56) | TACR3MAPK1MAPK13ROCK2RPS6KA5 | |
| SCHEMBL6451824 | 0.78 | TACR3 (1.00) | TACR3TACR2 | |
| SCHEMBL6448640 | 0.78 | TACR3 (1.00) | TACR3TACR2 | |
| SCHEMBL14114238 | 0.78 | ROCK2 (0.56) | TACR3MAPK1MAPK13ROCK2RPS6KA5 | |
| SCHEMBL23309543 | 0.75 | TACR3 (0.54) | TACR3MAPK1MAPK13ROCK2RPS6KA5 | |
| SCHEMBL30341569 | 0.75 | TACR3 (0.54) | TACR3MAPK1MAPK13ROCK2RPS6KA5 | |
| SCHEMBL9260283 | 0.74 | TACR3 (0.60) | TACR3MAPK1MAPK13ROCK2RPS6KA5 | |
| SCHEMBL28658687 | 0.74 | TACR3 (0.53) | TACR3MAPK1MAPK13ROCK2RPS6KA5 | |
| SCHEMBL31683870 | 0.74 | TACR3 (0.53) | TACR3MAPK1MAPK13ROCK2RPS6KA5 | |
| SCHEMBL9848822 | 0.74 | ROCK2 (0.70) | MAPK1MAPK13ROCK2RPS6KA5MAP4K4 |
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-115260178-A | Synthesis method and application of pyridine-skeleton NCN oxazoline ligand | 上海师范大学 | 2022-11-01 | — | — | CN | disclosed |