Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 12/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 11/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 11/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 10/20 | 0.34 |
| ▸ | TSHR | P16473 | 8/20 | 0.34 |
| ▸ | LMNA | P02545 | 6/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HBB | P68871 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 6/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.32 |
| ▸ | MKNK2 | Q9HBH9 | 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 | |
|---|---|---|---|---|
| SCHEMBL27535766 | 0.84 | FDPS (0.40) | FDPSHDAC1HDAC6LTA4HCYP1A2 | |
| SCHEMBL1371020 | 0.80 | FDPS (0.40) | FDPSHDAC1HDAC6LTA4HCYP1A2 | |
| SCHEMBL2563784 | 0.79 | FDPS (0.38) | FDPSHDAC1HDAC6LTA4HCYP1A2 | |
| SCHEMBL11543167 | 0.76 | FDPS (0.42) | FDPSHDAC1HDAC6LTA4HCYP1A2 | |
| SCHEMBL9081767 | 0.76 | HDAC1 (0.40) | FDPSHDAC1HDAC6LTA4HCYP1A2 | |
| SCHEMBL9175319 | 0.74 | FDPS (0.38) | FDPSHDAC1HDAC6CYP1A2CYP3A4 | |
| SCHEMBL5062453 | 0.73 | FDPS (0.54) | FDPSHDAC1HDAC6LTA4HCYP1A2 | |
| SCHEMBL29941724 | 0.73 | FDPS (0.54) | FDPSHDAC1HDAC6LTA4HCYP1A2 | |
| SCHEMBL27773228 | 0.72 | FDPS (0.37) | FDPSHDAC1HDAC6LTA4HCYP1A2 | |
| SCHEMBL27554930 | 0.72 | LTA4H (0.41) | FDPSHDAC1HDAC6LTA4HCYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117769554-A | Small molecule inhibitors of KRAS muteins | 大鹏药品工业株式会社 | 2024-03-26 | — | — | CN | disclosed |
| CN-117396472-A | SOS1 inhibitors and uses thereof | 上海齐鲁锐格医药研发有限公司 | 2024-01-12 | — | — | CN | disclosed |
| EP-0919562-B1 | PHOSPHONATE NUCLEOTIDE COMPOUNDS | MITSUBISHI CHEM CORP (JP) | 2002-11-06 | — | — | EP | disclosed |