Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.67 |
| ▸ | MAPT | P10636 | 2/20 | 0.67 |
| ▸ | ATM | Q13315 | 2/20 | 0.67 |
| ▸ | CASP1 | P29466 | 2/20 | 0.67 |
| ▸ | HTT | P42858 | 2/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.67 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.67 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.67 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29418017 | 0.90 | CYP1A2 (0.57) | ALDH1A1MAPTATMCASP1HTT | |
| SCHEMBL14678 | 0.90 | CYP1A2 (0.57) | ALDH1A1MAPTATMCASP1HTT | |
| SCHEMBL2853700 | 0.89 | ALDH1A1 (0.56) | ALDH1A1MAPTATMCASP1HTT | |
| Hydrochloric Acid SCHEMBL7362443 | 0.88 | CYP1A2 (0.55) | ALDH1A1MAPTATMCASP1HTT | |
| Hydrochloric Acid SCHEMBL29862578 | 0.88 | CYP1A2 (0.55) | ALDH1A1MAPTATMCASP1HTT | |
| Hydrochloric Acid SCHEMBL8324913 | 0.88 | CYP1A2 (0.55) | ALDH1A1MAPTATMCASP1HTT | |
| Quinoline SCHEMBL28085851 | 0.87 | ALDH1A1 (0.89) | ALDH1A1MAPTATMCASP1HTT | |
| Ethylene SCHEMBL28325267 | 0.86 | CYP1A2 (0.53) | ALDH1A1MAPTATMCASP1HTT | |
| Quinoline SCHEMBL28207051 | 0.85 | ALDH1A1 (0.85) | ALDH1A1MAPTATMCASP1HTT | |
| Quinoline SCHEMBL137291 | 0.82 | ALDH1A1 (0.94) | ALDH1A1MAPTATMCASP1HTT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108752339-B | A kind of synthetic method of quindoline and its derivative | 武汉工程大学 | 2019-10-22 | — | — | CN | disclosed |
| CN-109689647-A | The compound that bicyclic heteroaryl replaces | 百时美施贵宝公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-108752339-A | A kind of synthetic method of quindoline and its derivative | 武汉工程大学 | 2018-11-06 | — | — | CN | disclosed |
| CN-107709506-A | Surface conditioning agent containing the silane compound containing perfluor (poly-) ether | 大金工业株式会社 | 2018-02-16 | — | — | CN | disclosed |
| CN-106967134-A | It is a kind of to glycosylate 3 aminoquinoline compounds and preparation method thereof and be used as the application of pH probes | 浙江大学 | 2017-07-21 | — | — | CN | disclosed |