Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 10/20 | 0.44 |
| ▸ | LMNA | P02545 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28599185 | 0.86 | SMN1; SMN2 (0.46) | SMN1; SMN2HTTMAPK1MAPTLMNA | |
| SCHEMBL28521041 | 0.82 | SMN1; SMN2 (0.47) | SMN1; SMN2HTTMAPK1MAPTLMNA | |
| SCHEMBL1267498 | 0.80 | SMN1; SMN2 (0.66) | SMN1; SMN2HTTMAPK1MAPTLMNA | |
| SCHEMBL28522554 | 0.77 | SMN1; SMN2 (0.54) | SMN1; SMN2HTTMAPK1MAPTLMNA | |
| SCHEMBL11380421 | 0.71 | KMT2A (0.59) | SMN1; SMN2HTTMAPK1MAPTLMNA | |
| SCHEMBL29954298 | 0.71 | SMN1; SMN2 (0.49) | SMN1; SMN2HTTMAPK1MAPTLMNA | |
| SCHEMBL2563212 | 0.70 | KMT2A (0.49) | SMN1; SMN2HTTMAPK1MAPTLMNA | |
| SCHEMBL730547 | 0.70 | MAPT (0.50) | SMN1; SMN2HTTMAPK1MAPTLMNA | |
| SCHEMBL29953885 | 0.70 | MAPT (0.50) | SMN1; SMN2HTTMAPK1MAPTLMNA | |
| SCHEMBL15329669 | 0.70 | POLB (0.55) | SMN1; SMN2MAPK1MAPTLMNAALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113105433-B | Heterocyclic compound containing pyrazole ring and quinoline ring, preparation method and application thereof | 淮阴师范学院 | 2022-05-31 | — | — | CN | disclosed |
| CN-113105433-A | Heterocyclic compound containing pyrazole ring and quinoline ring, preparation method and application thereof | 淮阴师范学院 | 2021-07-13 | — | — | CN | disclosed |