Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28570208 | 1.00 | MAPK1 (0.61) | MAPK1CYP2C19MAPTLMNAHTT | |
| SCHEMBL28570202 | 0.86 | HTT (0.61) | MAPK1CYP2C19MAPTLMNAHTT | |
| SCHEMBL28583748 | 0.84 | GLA (0.59) | MAPK1CYP2C19MAPTLMNAHTT | |
| SCHEMBL30286895 | 0.84 | GLA (0.59) | MAPK1CYP2C19MAPTLMNAHTT | |
| SCHEMBL28914765 | 0.81 | KMT2A (0.63) | CYP2C19MAPTLMNAHTTKMT2A | |
| SCHEMBL28566966 | 0.78 | MAPT (0.70) | MAPK1CYP2C19MAPTLMNAHTT | |
| SCHEMBL1749397 | 0.78 | MAPK1 (0.53) | MAPK1CYP2C19KMT2AALDH1A1GRM4 | |
| SCHEMBL28578181 | 0.77 | ALDH1A1 (0.59) | MAPK1CYP2C19LMNAHTTKMT2A | |
| SCHEMBL28588260 | 0.77 | KMT2A (0.58) | CYP2C19MAPTLMNAHTTKMT2A | |
| SCHEMBL28588217 | 0.76 | GAA (0.70) | MAPK1CYP2C19MAPTKMT2AALDH1A1 |
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-112778156-B | Bishydrazide structure compound, preparation method and application thereof | 中国科学院上海药物研究所 | 2023-03-14 | — | — | CN | claimed |
| CN-112778156-B | Bishydrazide structure compound, preparation method and application thereof | 中国科学院上海药物研究所 | 2023-03-14 | — | — | CN | disclosed |