Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.40 |
| ▸ | CSNK1E | P49674 | 2/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | PRKDC | P78527 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28635512 | 0.85 | ALDH1A1 (0.46) | MAPK14RAB9ASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL28922558 | 0.85 | KDM4E (0.55) | MAPK14RAB9ASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL28623215 | 0.78 | ALDH1A1 (0.41) | HTR7RAB9ASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL8887630 | 0.78 | HTR7 (0.46) | HTR7MAPK14RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL28631506 | 0.78 | SMN1; SMN2 (0.47) | MAPK14RAB9ASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL30639606 | 0.78 | HTR7 (0.46) | HTR7MAPK14RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL28624647 | 0.77 | KDM4E (0.46) | MAPK14RAB9ASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL28623275 | 0.77 | CA1 (0.56) | MAPK14RAB9ASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL28622808 | 0.77 | CA1 (0.56) | MAPK14RAB9ASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL28622801 | 0.76 | MAPT (0.52) | MAPK14RAB9ASMN1; SMN2ALDH1A1NPC1 |
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-113372275-B | Synthetic method of 3, 5-diaryl-4-trifluoromethyl pyrazole derivative | 温州大学 | 2022-09-13 | — | — | CN | disclosed |
| CN-113372275-A | Synthetic method of 3, 5-diaryl-4-trifluoromethyl pyrazole derivative | 温州大学 | 2021-09-10 | — | — | CN | disclosed |