Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 3/20 | 0.38 |
| ▸ | PARP1 | P09874 | 4/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | RARB | P10826 | 2/20 | 0.33 |
| ▸ | RARG | P13631 | 2/20 | 0.33 |
| ▸ | RXRA | P19793 | 2/20 | 0.33 |
| ▸ | RARA | P10276 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL31474013 | 0.85 | RXRA (0.39) | KDM1AKDM4ECYP2C19RARBRARG | |
| SCHEMBL31474238 | 0.83 | RXRA (0.43) | DGAT1PARP1KDM1AROCK2RARB | |
| SCHEMBL31474036 | 0.80 | SYK (0.35) | KDM4ERARBRARGRXRARARA | |
| SCHEMBL30219292 | 0.71 | KDM1A (0.62) | KDM1AKDM4ECYP2C19MAPTALDH1A1 | |
| SCHEMBL811340 | 0.70 | DGAT1 (0.58) | DGAT1PARP1ROCK2KDM4ESCN9A | |
| SCHEMBL2323641 | 0.66 | DGAT1 (0.54) | DGAT1PARP1ROCK2KDM4ESCN9A | |
| SCHEMBL31474080 | 0.65 | RXRA (0.42) | RARBRARGRXRARARAALDH1A1 | |
| Hydrochloric Acid SCHEMBL29810612 | 0.64 | DGAT1 (0.52) | DGAT1PARP1ROCK2KDM4ESCN9A | |
| SCHEMBL23011977 | 0.64 | CA9 (0.45) | DGAT1 | |
| SCHEMBL4834475 | 0.63 | KDM4E (0.58) | KDM1AKDM4ECYP2C19RARBRARG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120081791-A | Heteroaryl compounds, process for their preparation and their use in medicine | 江苏恒瑞医药股份有限公司 | 2025-06-03 | — | — | CN | disclosed |
| WO-2025061148-A1 | HETEROARYL COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE | 江苏恒瑞医药股份有限公司 | 2025-03-27 | — | — | WO | disclosed |