Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 1.00 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 1.00 |
| ▸ | HPGD | P15428 | 2/20 | 1.00 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 1.00 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL823501 | 1.00 | KDM4E (1.00) | KDM4EALDH1A1HPGDHSD17B10DRD2 | |
| SCHEMBL8569982 | 0.85 | ALDH1A1 (0.73) | KDM4EALDH1A1HPGDHSD17B10DRD2 | |
| SCHEMBL16793536 | 0.83 | KDM4E (0.71) | KDM4EALDH1A1HPGDHSD17B10DRD2 | |
| SCHEMBL1154557 | 0.83 | KDM4E (0.71) | KDM4EALDH1A1HPGDHSD17B10DRD2 | |
| SCHEMBL10330185 | 0.82 | KDM4E (0.69) | KDM4EALDH1A1HPGDHSD17B10L3MBTL1 | |
| SCHEMBL3752176 | 0.81 | KDM4E (0.68) | KDM4EALDH1A1HPGDHSD17B10L3MBTL1 | |
| SCHEMBL10934231 | 0.81 | KDM4E (0.68) | KDM4EALDH1A1HPGDHSD17B10DRD2 | |
| SCHEMBL3076269 | 0.81 | KDM4E (0.68) | KDM4EALDH1A1HPGDHSD17B10DRD2 | |
| SCHEMBL9513713 | 0.81 | KDM4E (0.68) | KDM4EALDH1A1HPGDHSD17B10L3MBTL1 | |
| SCHEMBL2075341 | 0.81 | ALDH1A1 (0.68) | KDM4EALDH1A1HPGDHSD17B10DRD2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115181092-B | Pyrazine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2024-05-03 | — | — | CN | disclosed |
| CN-115181092-A | Pyrazine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2022-10-14 | — | — | CN | disclosed |
| CN-112279837-B | Pyrazine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2022-08-09 | — | — | CN | disclosed |
| CN-109879827-B | Indazole derivative and application thereof | 陕西理工大学 | 2022-05-31 | — | — | CN | disclosed |