Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 8/20 | 0.83 |
| ▸ | MAOA | P21397 | 1/20 | 0.72 |
| ▸ | MAOB | P27338 | 1/20 | 0.72 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.63 |
| ▸ | MAPT | P10636 | 4/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | TP53 | P04637 | 2/20 | 0.63 |
| ▸ | ATM | Q13315 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | DPP4 | P27487 | 1/20 | 0.61 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.61 |
| ▸ | RELA | Q04206 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL5424478 | 0.91 | ABCG2 (1.00) | ABCG2MAOAMAOBCYP3A4MAPT | |
| SCHEMBL5424480 | 0.91 | ABCG2 (1.00) | ABCG2MAOAMAOBCYP3A4MAPT | |
| SCHEMBL30138758 | 0.87 | ABCG2 (0.79) | ABCG2MAOAMAOBCYP3A4MAPT | |
| SCHEMBL5087999 | 0.85 | MAOB (0.88) | ABCG2MAOAMAOBCYP3A4MAPT | |
| SCHEMBL5088004 | 0.85 | MAOB (0.88) | ABCG2MAOAMAOBCYP3A4MAPT | |
| SCHEMBL10850912 | 0.84 | MAOA (0.77) | ABCG2MAOAMAOBCYP3A4MAPT | |
| SCHEMBL10850921 | 0.84 | MAOA (0.77) | ABCG2MAOAMAOBCYP3A4MAPT | |
| SCHEMBL13857112 | 0.84 | MAOB (1.00) | ABCG2MAOAMAOBCYP3A4MAPT | |
| SCHEMBL5085573 | 0.84 | MAOB (1.00) | ABCG2MAOAMAOBCYP3A4MAPT | |
| SCHEMBL5426849 | 0.83 | MAOA (0.76) | ABCG2MAOAMAOBCYP3A4MAPT |
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-115433073-A | Preparation method and application of kava piperine B analogue | 兰州大学 | 2022-12-06 | — | — | CN | disclosed |