Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.60 |
| ▸ | MAOB | P27338 | 2/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.60 |
| ▸ | HPGD | P15428 | 6/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.46 |
| ▸ | TYR | P14679 | 1/20 | 0.46 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.44 |
| ▸ | CDK7 | P50613 | 1/20 | 0.44 |
| ▸ | CDK9 | P50750 | 1/20 | 0.44 |
| ▸ | CCNH | P51946 | 1/20 | 0.44 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Angelicin SCHEMBL29468230 | 0.75 | MAOA (1.00) | MAOAMAOBNFKB1HPGDCYP1A1 | |
| Angelicin SCHEMBL376379 | 0.75 | MAOA (1.00) | MAOAMAOBNFKB1HPGDCYP1A1 | |
| Angelicin SCHEMBL8726499 | 0.75 | MAOA (1.00) | MAOAMAOBNFKB1HPGDCYP1A1 | |
| SCHEMBL11834062 | 0.74 | HPGD (0.66) | HPGDAKR1B1TYRDAOCYP1A1 | |
| SCHEMBL5723672 | 0.73 | MET (0.57) | MAOAMAOBNFKB1HPGDCYP1A1 | |
| SCHEMBL30226185 | 0.72 | CYP3A4 (0.65) | MAOAMAOBNFKB1HPGDAKR1B1 | |
| SCHEMBL4235603 | 0.71 | CYP3A4 (0.59) | MAOANFKB1HPGDAKR1B1TYR | |
| SCHEMBL2792438 | 0.71 | HPGD (0.62) | MAOAHPGDAKR1B1TYRDAO | |
| Psoralen SCHEMBL3980090 | 0.69 | MAOA (0.77) | MAOAMAOBNFKB1HPGDAKR1B1 | |
| SCHEMBL623741 | 0.68 | MAOA (0.62) | MAOAMAOBNFKB1HPGDCYP1A1 |
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-117368358-A | Method for measuring content of 3, 6-sinapioyl sucrose in traditional Chinese medicine formula Qifuyin by liquid chromatography-mass spectrometry | 山东省药学科学院 | 2024-01-09 | — | — | CN | claimed |
| CN-117368358-A | Method for measuring content of 3, 6-sinapioyl sucrose in traditional Chinese medicine formula Qifuyin by liquid chromatography-mass spectrometry | 山东省药学科学院 | 2024-01-09 | — | — | CN | disclosed |