Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.55 |
| ▸ | TP53 | P04637 | 4/20 | 0.52 |
| ▸ | THRB | P10828 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 5/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | UTRN | P46939 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5834473 | 0.81 | ALOX5 (0.54) | PTGS2TP53THRBMAPTALOX5 | |
| SCHEMBL5834587 | 0.80 | LMNA (0.59) | PTGS2TP53THRBMAPTALOX5 | |
| SCHEMBL5834548 | 0.79 | ALOX5 (0.51) | PTGS2TP53THRBMAPTALOX5 | |
| SCHEMBL11751608 | 0.79 | RAB9A (0.59) | TP53MAPTALOX5NPC1RAB9A | |
| SCHEMBL5834171 | 0.78 | NPC1 (0.58) | PTGS2TP53THRBMAPTALOX5 | |
| SCHEMBL12304351 | 0.78 | ALOX5 (0.52) | PTGS2TP53THRBMAPTALOX5 | |
| SCHEMBL12682368 | 0.78 | ALOX5 (0.74) | PTGS2TP53THRBALOX5NPC1 | |
| SCHEMBL5834837 | 0.78 | ALOX5 (0.55) | PTGS2TP53THRBMAPTALOX5 | |
| SCHEMBL5834972 | 0.77 | ALOX5 (0.55) | PTGS2TP53THRBMAPTALOX5 | |
| SCHEMBL12304261 | 0.77 | PTGS2 (0.49) | PTGS2TP53THRBMAPTALOX5 |
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-115960073-B | N-halogenated acetyl diphenylamine derivative and preparation method and medical application thereof | 中国药科大学 | 2024-09-27 | — | — | CN | disclosed |
| CN-115960073-A | N-halogenated acetyl diphenylamine derivative and preparation method and medical application thereof | 中国药科大学 | 2023-04-14 | — | — | CN | disclosed |