Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.62 |
| ▸ | MAPT | P10636 | 3/20 | 0.62 |
| ▸ | HTT | P42858 | 3/20 | 0.62 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | ALPL | P05186 | 1/20 | 0.57 |
| ▸ | ALPI | P09923 | 1/20 | 0.57 |
| ▸ | ALPG | P10696 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 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 | |
|---|---|---|---|---|
| SCHEMBL28568876 | 0.83 | HTT (0.72) | SMN1; SMN2KDM4EMAPTHTTLMNA | |
| SCHEMBL28914765 | 0.81 | KMT2A (0.63) | SMN1; SMN2KDM4EMAPTHTTLMNA | |
| SCHEMBL28583698 | 0.81 | POLB (0.63) | SMN1; SMN2KDM4EMAPTHTTLMNA | |
| SCHEMBL28588260 | 0.80 | KMT2A (0.58) | SMN1; SMN2KDM4EMAPTHTTLMNA | |
| SCHEMBL28571282 | 0.75 | ALDH1A1 (0.68) | SMN1; SMN2KDM4EMAPTHTTLMNA | |
| SCHEMBL28573979 | 0.75 | SMN1; SMN2 (0.58) | SMN1; SMN2KDM4EMAPTHTTLMNA | |
| SCHEMBL28566966 | 0.75 | MAPT (0.70) | SMN1; SMN2KDM4EMAPTHTTLMNA | |
| SCHEMBL28583712 | 0.74 | ALDH1A1 (0.52) | SMN1; SMN2MAPTLMNAALDH1A1CYP2C19 | |
| SCHEMBL28575018 | 0.73 | MAPT (0.55) | SMN1; SMN2MAPTLMNAALDH1A1CYP2C19 | |
| SCHEMBL24438113 | 0.72 | PTPN1 (0.67) | SMN1; SMN2MAPTLMNAALDH1A1KMT2A |
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 4 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-A | Bishydrazide structure compound, preparation method and application thereof | 中国科学院上海药物研究所 | 2021-05-11 | — | — | 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 |
| CN-112778156-A | Bishydrazide structure compound, preparation method and application thereof | 中国科学院上海药物研究所 | 2021-05-11 | — | — | CN | disclosed |