Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | L3MBTL3 | Q96JM7 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17593575 | 0.89 | USP2 (0.38) | USP2CYP2D6HDAC4MAPK1CYP3A4 | |
| SCHEMBL1028689 | 0.88 | HDAC4 (0.45) | USP2CYP2D6HDAC4CYP3A4CYP2C19 | |
| SCHEMBL5795262 | 0.79 | — | — | |
| SCHEMBL2975291 | 0.79 | CYP2C19 (0.36) | USP2CYP2D6MAPK1CYP3A4CYP2C19 | |
| SCHEMBL2885644 | 0.78 | L3MBTL3 (0.33) | HDAC4TSHRL3MBTL3 | |
| SCHEMBL2975765 | 0.78 | USP2 (0.46) | USP2CYP2D6MAPK1CYP3A4CYP2C19 | |
| SCHEMBL24093710 | 0.75 | LTA4H (0.44) | USP2CYP2D6HDAC4MAPK1TP53 | |
| SCHEMBL16400663 | 0.75 | KDM4E (0.53) | HDAC4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL2692445 | 0.75 | MAPT (0.59) | USP2HDAC4MAPK1CYP2C19MEN1 | |
| SCHEMBL22816129 | 0.75 | AKR1C3 (0.42) | USP2CYP2D6HDAC4MAPK1MEN1 |
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-108473439-B | Pyrazolone derivatives as nitroxyl donors | 卡尔迪奥克斯尔制药公司 | 2022-03-15 | — | — | CN | disclosed |