Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.52 |
| ▸ | FGFR1 | P11362 | 4/20 | 0.52 |
| ▸ | KDR | P35968 | 4/20 | 0.52 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29664327 | 0.84 | GAA (0.53) | EGFRFGFR1KDRMEN1KMT2A | |
| SCHEMBL29664346 | 0.83 | HPGD (0.53) | EGFRFGFR1KDRMEN1KMT2A | |
| SCHEMBL29664287 | 0.80 | DRD2 (0.46) | MEN1KMT2ARAB9ANPC1ALDH1A1 | |
| SCHEMBL29664519 | 0.78 | GAA (0.43) | EGFRFGFR1KDRMEN1KMT2A | |
| SCHEMBL15149138 | 0.77 | AURKA (0.50) | EGFRKDRABCB11HDAC6MEN1 | |
| SCHEMBL16023810 | 0.75 | AURKA (0.48) | EGFRFGFR1KDRABCB11HDAC6 | |
| SCHEMBL16013030 | 0.75 | RPS6KA3 (0.54) | EGFRMEN1KMT2AALDH1A1CYP1A2 | |
| SCHEMBL15152315 | 0.75 | RAB9A (0.50) | KDRMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL316390 | 0.75 | RAB9A (0.81) | EGFRMEN1KMT2ARAB9ANPC1 | |
| SCHEMBL9479393 | 0.75 | RAB9A (0.81) | EGFRMEN1KMT2ARAB9ANPC1 |
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-114728909-A | Composition for preventing or treating cancer comprising novel trifluoromethylphenylpyrazole derivative as active ingredient | 韩国原子力医学院 | 2022-07-08 | — | — | CN | disclosed |