Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | CTSK | P43235 | 7/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CTSS | P25774 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | P2RY2 | P41231 | 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 | |
|---|---|---|---|---|
| SCHEMBL24924766 | 0.90 | CYP1A2 (0.58) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL5148908 | 0.90 | CYP1A2 (0.58) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL17369171 | 0.90 | CTSK (0.49) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL29411192 | 0.86 | CYP1A2 (0.54) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL7389613 | 0.84 | CYP1A2 (0.53) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL13560958 | 0.83 | CYP1A2 (0.61) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL14483921 | 0.83 | CYP1A2 (0.61) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL29508434 | 0.83 | CYP1A2 (0.61) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL4278142 | 0.83 | CYP1A2 (0.54) | CYP1A2CYP2C9CYP2C19HTTCTSK | |
| SCHEMBL8061219 | 0.83 | CYP1A2 (0.54) | CYP1A2CYP2C9CYP2C19HTTCTSK |
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-113993850-B | Modulators of integrated stress response pathways | 埃沃特克国际有限责任公司 | 2024-03-29 | — | — | CN | disclosed |