Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | POLR1A | O95602 | 1/20 | 0.39 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28419925 | 0.88 | SMN1; SMN2 (0.49) | ALDH1A1POLR1ASMN1; SMN2TP53L3MBTL1 | |
| SCHEMBL28796059 | 0.83 | KMT2A (0.41) | ALDH1A1SMN1; SMN2TP53L3MBTL1MAPT | |
| SCHEMBL28421990 | 0.83 | RXFP1 (0.46) | ALDH1A1TP53MAPTKMT2ACA2 | |
| SCHEMBL28416681 | 0.82 | RXFP1 (0.43) | ALDH1A1TP53MAPTLMNARXFP1 | |
| SCHEMBL28416663 | 0.81 | MEN1 (0.40) | ALDH1A1SMN1; SMN2TP53L3MBTL1MAPT | |
| SCHEMBL28416682 | 0.77 | L3MBTL1 (0.37) | SMN1; SMN2TP53L3MBTL1MAPTKMT2A | |
| SCHEMBL28421991 | 0.74 | KMT2A (0.37) | SMN1; SMN2TP53L3MBTL1MAPTKMT2A | |
| SCHEMBL29889835 | 0.73 | ALDH1A1 (0.39) | ALDH1A1POLR1AKDM5BSMN1; SMN2TP53 | |
| SCHEMBL29889909 | 0.72 | MEN1 (0.46) | ALDH1A1SMN1; SMN2MAPTKMT2AMEN1 | |
| SCHEMBL28427552 | 0.71 | TARBP2 (0.46) | ALDH1A1SMN1; SMN2L3MBTL1MAPTKMT2A |
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-110981819-A | Quinoxaline signal channel inhibitor and preparation method and application thereof | 广西师范大学 | 2020-04-10 | — | — | CN | disclosed |