Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.58 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.58 |
| ▸ | RELA | Q04206 | 2/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.55 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.55 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.54 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL18898428 | 0.89 | SMN1; SMN2 (0.57) | NPC1RAB9ASMN1; SMN2KDM4EMAPT | |
| SCHEMBL13170651 | 0.79 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2KDM4EMAPT | |
| SCHEMBL32667946 | 0.78 | PDGFRB (0.77) | NPC1RAB9AMAPTALDH1A1CLK4 | |
| SCHEMBL2772360 | 0.78 | PDGFRB (0.77) | NPC1RAB9AMAPTALDH1A1CLK4 | |
| SCHEMBL3522560 | 0.78 | ALDH1A1 (0.61) | NPC1RAB9ASMN1; SMN2KDM4EMAPT | |
| SCHEMBL24621829 | 0.75 | PDGFRB (0.72) | NPC1RAB9AKDM4ECLK4PIK3CA | |
| SCHEMBL29375510 | 0.75 | PDGFRB (0.72) | NPC1RAB9AKDM4ECLK4PIK3CA | |
| SCHEMBL30323720 | 0.75 | BIRC5 (0.77) | NPC1RAB9AKDM4ECLK4PIK3CA | |
| SCHEMBL26829682 | 0.75 | PDGFRB (0.72) | NPC1RAB9AKDM4ECLK4PIK3CA | |
| SCHEMBL27631118 | 0.75 | BIRC5 (0.77) | NPC1RAB9AKDM4ECLK4PIK3CA |
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-114031552-A | Method for synthesizing substituted quinoline derivative from aromatic aldehyde and aromatic amine participated in DMSO | 长沙资材科技有限公司 | 2022-02-11 | — | — | CN | disclosed |