Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 1/20 | 0.51 |
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 13/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 10/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.35 |
| ▸ | USP2 | O75604 | 4/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 6/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | HBB | P68871 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6259635 | 0.82 | FDPS (0.55) | FDPSLTA4HHDAC1HDAC6CYP1A2 | |
| SCHEMBL4020850 | 0.82 | FDPS (0.51) | FDPSLTA4HHDAC1HDAC6CYP1A2 | |
| SCHEMBL31024294 | 0.82 | FDPS (0.51) | FDPSLTA4HHDAC1HDAC6CYP1A2 | |
| SCHEMBL4020843 | 0.82 | FDPS (0.51) | FDPSLTA4HHDAC1HDAC6CYP1A2 | |
| SCHEMBL5017277 | 0.82 | FDPS (0.51) | FDPSLTA4HHDAC1HDAC6CYP1A2 | |
| SCHEMBL10163117 | 0.82 | FDPS (0.51) | FDPSLTA4HHDAC1HDAC6CYP1A2 | |
| SCHEMBL9597540 | 0.82 | FDPS (0.55) | FDPSLTA4HHDAC1HDAC6CYP1A2 | |
| SCHEMBL30166038 | 0.82 | FDPS (0.55) | FDPSLTA4HHDAC1HDAC6CYP1A2 | |
| SCHEMBL5017550 | 0.81 | FDPS (0.50) | FDPSLTA4HHDAC1HDAC6CYP1A2 | |
| Iodide SCHEMBL28673349 | 0.81 | FDPS (0.50) | FDPSLTA4HHDAC1HDAC6CYP1A2 |
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-108314685-A | A kind of chloro- 9- of 2- amino -6-（4- acetoxy-3s-acetyl-o-methyl butyl）The preparation method of purine | 上药康丽（常州）药业有限公司 | 2018-07-24 | — | — | CN | claimed |
| CN-108314685-A | A kind of chloro- 9- of 2- amino -6-（4- acetoxy-3s-acetyl-o-methyl butyl）The preparation method of purine | 上药康丽（常州）药业有限公司 | 2018-07-24 | — | — | CN | disclosed |