Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 3/20 | 0.48 |
| ▸ | ESR1 | P03372 | 2/20 | 0.48 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.48 |
| ▸ | PRKCA | P17252 | 1/20 | 0.48 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.48 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | XDH | P47989 | 2/20 | 0.42 |
| ▸ | SLCO1B3 | Q9NPD5 | 3/20 | 0.42 |
| ▸ | SLCO1B1 | Q9Y6L6 | 3/20 | 0.42 |
| ▸ | SLCO2B1 | O94956 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13111972 | 0.86 | PDPK1 (0.51) | BACE1ESR1PDPK1PRKCAPRKCQ | |
| SCHEMBL27013475 | 0.84 | ESR1 (0.68) | BACE1ESR1PDPK1PRKCAPRKCQ | |
| SCHEMBL27006405 | 0.84 | ESR1 (0.68) | BACE1ESR1PDPK1PRKCAPRKCQ | |
| SCHEMBL28485097 | 0.80 | ESR1 (0.71) | BACE1ESR1PDPK1PRKCAPRKCQ | |
| SCHEMBL15386081 | 0.73 | BACE1 (0.68) | BACE1ESR1PDPK1PRKCAPRKCQ | |
| Neophellamuretin SCHEMBL27013455 | 0.72 | ABCG2 (0.66) | BACE1ESR1PDPK1PRKCAPRKCQ | |
| Neophellamuretin SCHEMBL30766255 | 0.72 | ABCG2 (0.66) | BACE1ESR1PDPK1PRKCAPRKCQ | |
| SCHEMBL13750522 | 0.72 | ALDH1A1 (0.63) | XDHSLCO1B3SLCO1B1SLCO2B1ALDH1A1 | |
| SCHEMBL571508 | 0.71 | ESR1 (0.76) | BACE1ESR1PDPK1PRKCAPRKCQ | |
| Kushenol N SCHEMBL564366 | 0.70 | BACE1 (0.73) | BACE1ESR1PDPK1PRKCAPRKCQ |
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-114796188-A | Plant-derived flavone antibacterial compound and application thereof | 朱奎 | 2022-07-29 | — | — | CN | claimed |
| CN-112569223-A | Plant-derived flavone antibacterial compound and application thereof | 朱奎 | 2021-03-30 | — | — | CN | claimed |