Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.69 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.69 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.69 |
| ▸ | MAPT | P10636 | 8/20 | 0.60 |
| ▸ | TP53 | P04637 | 7/20 | 0.60 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 6/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | CASP1 | P29466 | 4/20 | 0.58 |
| ▸ | CASP7 | P55210 | 4/20 | 0.58 |
| ▸ | HPGD | P15428 | 4/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.57 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL25229828 | 1.00 | CYP1A2 (0.69) | CYP1A2CYP1A1CYP1B1MAPTTP53 | |
| SCHEMBL25206376 | 0.86 | MAPT (0.67) | CYP1A2CYP1A1CYP1B1MAPTTP53 | |
| SCHEMBL10068185 | 0.86 | KDM4E (0.73) | CYP1A2CYP1A1CYP1B1MAPTTP53 | |
| SCHEMBL25205192 | 0.86 | CYP1A1 (0.67) | CYP1A2CYP1A1CYP1B1MAPTTP53 | |
| SCHEMBL25230489 | 0.86 | CYP1B1 (0.65) | CYP1A2CYP1A1CYP1B1MAPTTP53 | |
| SCHEMBL30397431 | 0.85 | CYP1A2 (0.70) | CYP1A2CYP1A1CYP1B1MAPTTP53 | |
| SCHEMBL25208596 | 0.85 | CYP1A2 (0.70) | CYP1A2CYP1A1CYP1B1MAPTTP53 | |
| SCHEMBL25234796 | 0.84 | KDM4E (0.65) | CYP1A2CYP1A1CYP1B1MAPTTP53 | |
| SCHEMBL25231488 | 0.83 | CYP1A2 (0.57) | CYP1A2CYP1A1CYP1B1MAPTTP53 | |
| SCHEMBL25235022 | 0.83 | ABCB1 (0.79) | CYP1A2CYP1A1CYP1B1MAPTTP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023090908-A1 | NOVEL FLAVONOID DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF METABOLIC DISEASE | 고려대학교 세종산학협력단 | 2023-05-25 | — | — | WO | disclosed |