Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 5/20 | 0.76 |
| ▸ | MAPT | P10636 | 5/20 | 0.76 |
| ▸ | ACHE | P22303 | 2/20 | 0.65 |
| ▸ | PARK7 | Q99497 | 3/20 | 0.64 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | ALDH2 | P05091 | 5/20 | 0.47 |
| ▸ | ALDH3A1 | P30838 | 5/20 | 0.47 |
| ▸ | APAF1 | O14727 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28070652 | 0.87 | TP53 (0.65) | TP53MAPTACHEPARK7CHRM5 | |
| SCHEMBL2459977 | 0.81 | TP53 (0.80) | TP53MAPTACHEPARK7CHRM5 | |
| SCHEMBL28053364 | 0.79 | ACHE (1.00) | TP53MAPTACHEPARK7CHRM5 | |
| SCHEMBL28070701 | 0.78 | MAPT (0.57) | TP53MAPTACHEPARK7CHRM5 | |
| SCHEMBL4739092 | 0.78 | PARK7 (0.82) | TP53MAPTACHEPARK7CHRM5 | |
| SCHEMBL30774299 | 0.78 | PARK7 (0.82) | TP53MAPTACHEPARK7CHRM5 | |
| SCHEMBL4736390 | 0.78 | PARK7 (1.00) | TP53MAPTACHEPARK7CHRM5 | |
| SCHEMBL28070743 | 0.76 | TP53 (0.51) | TP53MAPTACHEPARK7CHRM5 | |
| SCHEMBL11147982 | 0.72 | ALDH1A1 (0.50) | TP53MAPTPARK7SMN1; SMN2TDP1 | |
| SCHEMBL20874420 | 0.72 | PARK7 (0.80) | TP53MAPTACHEPARK7CHRM5 |
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-105541808-A | Metronidazole-isatin type compound as well as preparation method and application thereof | UNIV JISHOU | 2016-05-04 | — | — | CN | disclosed |