Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FBP1 | P09467 | 8/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| SCHEMBL29247991 | 1.00 | FBP1 (0.48) | FBP1MEN1JAK2MITFALDH1A1 | |
| SCHEMBL29248020 | 0.82 | FBP1 (0.65) | FBP1MEN1JAK2MITFALDH1A1 | |
| SCHEMBL29248025 | 0.82 | FBP1 (0.65) | FBP1MEN1JAK2MITFALDH1A1 | |
| SCHEMBL29248047 | 0.81 | FBP1 (0.49) | FBP1MEN1JAK2MITFALDH1A1 | |
| SCHEMBL29248076 | 0.81 | FBP1 (0.65) | FBP1ALDH1A1MAPTHSD17B10PTGS2 | |
| SCHEMBL29248071 | 0.81 | FBP1 (0.65) | FBP1ALDH1A1MAPTHSD17B10PTGS2 | |
| SCHEMBL29248045 | 0.81 | FBP1 (0.49) | FBP1MEN1JAK2MITFALDH1A1 | |
| SCHEMBL29248062 | 0.80 | FBP1 (0.53) | FBP1ALDH1A1CYP1A2CYP3A4MAPT | |
| SCHEMBL29248023 | 0.80 | CYP1A2 (0.43) | FBP1MEN1JAK2MITFALDH1A1 | |
| SCHEMBL29248029 | 0.80 | CYP1A2 (0.43) | FBP1MEN1JAK2MITFALDH1A1 |
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-116655536-A | Class N 1 -aryl-3-fluoroalkyl-5-fluoropyrazole compound, and preparation method and application thereof | 天津大学 | 2023-08-29 | — | — | CN | disclosed |