Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VKORC1 | Q9BQB6 | 2/20 | 0.67 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.51 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | MGAM | O43451 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | SI | P14410 | 2/20 | 0.48 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28552754 | 1.00 | VKORC1 (0.67) | VKORC1ALOX15ABCG2CYP19A1MGAM | |
| SCHEMBL28369886 | 0.99 | VKORC1 (0.65) | VKORC1ALOX15ABCG2CYP19A1MGAM | |
| SCHEMBL623887 | 0.88 | VKORC1 (0.59) | VKORC1ALOX15ABCG2CYP19A1GAA | |
| SCHEMBL27971484 | 0.87 | VKORC1 (0.51) | VKORC1ALOX15ABCG2CYP19A1MGAM | |
| SCHEMBL29699624 | 0.85 | VKORC1 (0.74) | VKORC1ALOX15ABCG2CYP19A1MGAM | |
| SCHEMBL5309695 | 0.80 | VKORC1 (1.00) | VKORC1ALOX15MGAMGAASI | |
| SCHEMBL5309688 | 0.80 | VKORC1 (1.00) | VKORC1ALOX15MGAMGAASI | |
| SCHEMBL16768172 | 0.79 | VKORC1 (0.97) | VKORC1ALOX15MGAMGAASI | |
| SCHEMBL27006404 | 0.78 | PTPN1 (0.53) | VKORC1ABCG2CYP19A1MGAMGAA | |
| SCHEMBL9019380 | 0.75 | DDR2 (0.60) | ALOX15ABCG2CYP19A1GAAPTPN1 |
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-111961021-B | Separation and purification process of geranylflavone A | 云南汉盟制药有限公司 | 2021-08-03 | — | — | CN | disclosed |
| CN-111961021-A | Separation and purification process of high-purity geranylflavonoid A | 云南汉盟制药有限公司 | 2020-11-20 | — | — | CN | disclosed |
| CN-107082780-B | Alkaloid with pyrroloisoquinoline structure and preparation method and application thereof | 山东省医学科学院药物研究所 | 2020-08-14 | — | — | CN | disclosed |