Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 8/20 | 1.00 |
| ▸ | CYP1B1 | Q16678 | 8/20 | 1.00 |
| ▸ | CYP1A2 | P05177 | 5/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.71 |
| ▸ | NPC1 | O15118 | 2/20 | 0.71 |
| ▸ | RAB9A | P51151 | 2/20 | 0.71 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.71 |
| ▸ | HPGD | P15428 | 2/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.71 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.71 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.71 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.71 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.71 |
| ▸ | PRKACA | P17612 | 1/20 | 0.71 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.71 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.71 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.71 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.71 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL7047647 | 1.00 | CYP1A1 (1.00) | CYP1A1CYP1B1CYP1A2KDM4ENPC1 | |
| SCHEMBL9605438 | 0.89 | CYP1A1 (0.80) | CYP1A1CYP1B1CYP1A2KDM4ENPC1 | |
| SCHEMBL22594971 | 0.84 | CYP1A1 (0.71) | CYP1A1CYP1B1CYP1A2KDM4ENPC1 | |
| SCHEMBL8050491 | 0.83 | CYP1A2 (1.00) | CYP1A1CYP1B1CYP1A2KDM4ENPC1 | |
| SCHEMBL8046590 | 0.83 | CYP1A2 (1.00) | CYP1A1CYP1B1CYP1A2KDM4ENPC1 | |
| SCHEMBL6833668 | 0.83 | ROCK2 (1.00) | CYP1A1CYP1B1CYP1A2KDM4ENPC1 | |
| SCHEMBL1743365 | 0.82 | CYP1A1 (1.00) | CYP1A1CYP1B1CYP1A2KDM4ENPC1 | |
| SCHEMBL1743363 | 0.82 | CYP1A1 (1.00) | CYP1A1CYP1B1CYP1A2KDM4ENPC1 | |
| SCHEMBL22009168 | 0.82 | CYP1A1 (0.69) | CYP1A1CYP1B1CYP1A2KDM4ENPC1 | |
| Trismethoxyresveratrol SCHEMBL918739 | 0.81 | CYP1A1 (1.00) | CYP1A1CYP1B1CYP1A2KDM4ENPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118530166-A | Azastilbene compounds and application thereof in prevention and treatment of metabolic syndrome | 中国医学科学院药物研究所 | 2024-08-23 | — | — | CN | claimed |
| CN-118530166-A | Azastilbene compounds and application thereof in prevention and treatment of metabolic syndrome | 中国医学科学院药物研究所 | 2024-08-23 | — | — | CN | disclosed |
| WO-2003018013-A1 | STILBENE DERIVATIVE HAVING CYTOCHROME P450 1B1 INHIBITORY ACTIVITY, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, METHOD FOR PREPARING THE SAME, AND COMPOSITION INCLUDING THE SAME | PROMEDITECH, INC. (KR) | 2003-03-06 | — | — | WO | disclosed |