Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | GLS | O94925 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30620942 | 1.00 | CYP1A2 (0.49) | CYP1A2CYP2C9CYP2C19ACHECYP1B1 | |
| SCHEMBL5109433 | 0.90 | CYP1A2 (0.51) | CYP1A2CYP2C9CYP2C19ACHECYP1B1 | |
| SCHEMBL1581709 | 0.82 | CYP1B1 (0.59) | CYP1A2CYP2C9CYP2C19ACHECYP1B1 | |
| SCHEMBL22951177 | 0.79 | ACHE (0.46) | CYP1A2CYP2C9CYP2C19ACHECYP1B1 | |
| SCHEMBL7284067 | 0.77 | CYP2C9 (0.49) | CYP1A2CYP2C9CYP2C19ACHECYP1B1 | |
| SCHEMBL30657539 | 0.77 | CYP1B1 (0.62) | CYP1A2CYP2C9CYP2C19ACHECYP1B1 | |
| Cyanide SCHEMBL27937317 | 0.77 | CYP1B1 (0.55) | CYP1A2CYP2C9CYP2C19ACHECYP1B1 | |
| SCHEMBL8247166 | 0.77 | CYP1B1 (0.62) | CYP1A2CYP2C9CYP2C19ACHECYP1B1 | |
| SCHEMBL6789650 | 0.77 | ACHE (0.69) | CYP1A2CYP2C9CYP2C19ACHEGLS | |
| SCHEMBL20660370 | 0.76 | CYP1A2 (0.46) | CYP1A2CYP2C9CYP2C19ACHECYP1B1 |
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-116947856-A | EZH2 inhibitor and preparation method and application thereof | 星希尔生物科技(上海)有限公司 | 2023-10-27 | — | — | CN | disclosed |