Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PI4KA | P42356 | 1/20 | 0.36 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.36 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.36 |
| ▸ | FDPS | P14324 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | LTA4H | P09960 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | HBB | P68871 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8836046 | 0.81 | FDPS (0.38) | PI4KAPI4K2BPI4K2API4KBFDPS | |
| SCHEMBL27438643 | 0.81 | FDPS (0.35) | PI4KAPI4K2BPI4K2API4KBFDPS | |
| SCHEMBL29380629 | 0.72 | FDPS (0.35) | FDPSMKNK2HDAC1HDAC6ALDH1A1 | |
| SCHEMBL29141643 | 0.71 | HDAC1 (0.40) | FDPSMKNK2HDAC1HDAC6LTA4H | |
| SCHEMBL10668441 | 0.70 | PI4KA (0.55) | PI4KAPI4K2BPI4K2API4KBFDPS | |
| SCHEMBL11904786 | 0.68 | FDPS (0.32) | FDPS | |
| SCHEMBL5633 | 0.67 | FDPS (0.42) | FDPSMKNK2HDAC1HDAC6LTA4H | |
| SCHEMBL2120550 | 0.67 | FDPS (0.45) | FDPSMKNK2HDAC1HDAC6LTA4H | |
| SCHEMBL28075428 | 0.66 | FDPS (0.41) | FDPSMKNK2HDAC1HDAC6LTA4H | |
| Hydrochloric Acid SCHEMBL357698 | 0.66 | FDPS (0.41) | FDPSMKNK2HDAC1HDAC6LTA4H |
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-1291983-A | 6,9-Disubstituted 2-[trans-(4-aminocyclohexyl) amino] purines | AVENTIS PHARMA INC (US) | 2001-04-18 | — | — | CN | disclosed |