Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 7/20 | 0.64 |
| ▸ | TDO2 | P48775 | 3/20 | 0.60 |
| ▸ | GSK3B | P49841 | 2/20 | 0.55 |
| ▸ | EGFR | P00533 | 3/20 | 0.54 |
| ▸ | SRC | P12931 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | BLM | P54132 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29437202 | 0.85 | EGFR (0.69) | IDO1TDO2GSK3BEGFRALDH1A1 | |
| SCHEMBL1302976 | 0.85 | EGFR (0.69) | IDO1TDO2GSK3BEGFRALDH1A1 | |
| SCHEMBL6925979 | 0.83 | IDO1 (0.57) | IDO1TDO2GSK3BEGFRALDH1A1 | |
| SCHEMBL14555787 | 0.83 | IDO1 (0.57) | IDO1TDO2GSK3BEGFRALDH1A1 | |
| SCHEMBL1388673 | 0.82 | EGFR (0.74) | IDO1TDO2GSK3BEGFRSRC | |
| SCHEMBL1542794 | 0.80 | IDO1 (0.77) | IDO1TDO2GSK3BEGFRSRC | |
| SCHEMBL8998987 | 0.80 | EGFR (0.72) | IDO1TDO2GSK3BEGFRALDH1A1 | |
| Hydrochloric Acid SCHEMBL7419440 | 0.79 | IDO1 (0.74) | IDO1TDO2GSK3BEGFRSRC | |
| SCHEMBL1461848 | 0.79 | IDO1 (0.64) | IDO1TDO2GSK3BEGFRALDH1A1 | |
| SCHEMBL24740358 | 0.78 | IDO1 (1.00) | IDO1TDO2GSK3BEGFRSRC |
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-118338898-A | Small molecule inhibitors of oncogenic CHD1L with preclinical anti-colorectal cancer activity | 科罗拉多州立大学董事会（法人团体） | 2024-07-12 | — | — | CN | disclosed |
| CN-108033921-B | 3, 5-diamino-6-chloro-N- (N- (4- (4- (2- (hexyl (2,3,4,5, 6-pentahydroxyhexyl) amino) ethoxy) phenyl) butyl) carbamimidoyl) pyrazine-2-carboxamide | 帕里昂科学公司 | 2021-07-20 | — | — | CN | disclosed |
| CN-107667092-B | Formylated N-heterocyclic derivatives as FGFR4 inhibitors | 诺华股份有限公司 | 2021-05-28 | — | — | CN | disclosed |