Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BLM | P54132 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | AOC1 | P19801 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Guanidine SCHEMBL28727359 | 0.85 | — | — | |
| SCHEMBL28727353 | 0.84 | — | — | |
| Hydrazine SCHEMBL28727352 | 0.83 | ALDH1A1 (0.33) | TSHR | |
| SCHEMBL28727379 | 0.82 | ALDH1A1 (0.36) | TSHR | |
| SCHEMBL29523917 | 0.80 | ALDH1A1 (0.35) | TSHR | |
| Potassium SCHEMBL29523905 | 0.80 | ALDH1A1 (0.35) | TSHR | |
| Pimagedine SCHEMBL28727357 | 0.78 | — | — | |
| Pimagedine SCHEMBL4539960 | 0.67 | TSHR (0.53) | BLMKDM4EMEN1CYP1A2CYP3A4 | |
| Pimagedine SCHEMBL239260 | 0.67 | — | — | |
| Pimagedine SCHEMBL11442598 | 0.65 | MEN1 (0.50) | BLMKDM4EMEN1CYP1A2CYP3A4 |
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-110128344-B | N-substituted-3, 5-dinitropyrazole compound and preparation method thereof | 中国科学院上海有机化学研究所 | 2022-04-01 | — | — | CN | disclosed |