Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | MAPK13 | O15264 | 4/20 | 0.48 |
| ▸ | MAPK12 | P53778 | 4/20 | 0.48 |
| ▸ | MAPK11 | Q15759 | 4/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.48 |
| ▸ | GCGR | P47871 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.45 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.45 |
| ▸ | CSF1R | P07333 | 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 | |
|---|---|---|---|---|
| SCHEMBL28623275 | 1.00 | CA1 (0.56) | CA1CA2MAPK13MAPK12MAPK11 | |
| SCHEMBL28922558 | 0.91 | KDM4E (0.55) | CA1CA2MAPK13MAPK12MAPK11 | |
| SCHEMBL28631506 | 0.86 | SMN1; SMN2 (0.47) | CA1CA2MAPK13MAPK12MAPK11 | |
| SCHEMBL28624647 | 0.85 | KDM4E (0.46) | MAPK13MAPK12MAPK11MAPK14GCGR | |
| SCHEMBL28635512 | 0.85 | ALDH1A1 (0.46) | CA1CA2MAPK13MAPK12MAPK11 | |
| SCHEMBL28622801 | 0.81 | MAPT (0.52) | MAPK13MAPK12MAPK11MAPK14KDM4E | |
| SCHEMBL28621872 | 0.81 | MAPT (0.52) | MAPK13MAPK12MAPK11MAPK14KDM4E | |
| SCHEMBL28616557 | 0.77 | HTR7 (0.43) | MAPK13MAPK12MAPK11MAPK14KDM4E | |
| SCHEMBL28003450 | 0.76 | CA1 (0.60) | CA1CA2MAPK13MAPK12MAPK11 | |
| SCHEMBL28623215 | 0.75 | ALDH1A1 (0.41) | KDM4EALDH1A1GAARAB9ASMN1; SMN2 |
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 |