Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 3/20 | 0.69 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.68 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.68 |
| ▸ | TP53 | P04637 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.67 |
| ▸ | HPGD | P15428 | 3/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.67 |
| ▸ | FYN | P06241 | 1/20 | 0.67 |
| ▸ | AURKA | O14965 | 1/20 | 0.66 |
| ▸ | KDR | P35968 | 1/20 | 0.66 |
| ▸ | FLT3 | P36888 | 1/20 | 0.66 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.66 |
| ▸ | CSNK2A2 | P19784 | 8/20 | 0.65 |
| ▸ | CSNK2B | P67870 | 8/20 | 0.65 |
| ▸ | CSNK2A1 | P68400 | 8/20 | 0.65 |
| ▸ | KDM1A | O60341 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL10068612 | 0.92 | CSNK2A2 (0.69) | KDM4EALDH1A1HSD17B10CYP2C19CYP2D6 | |
| SCHEMBL7603180 | 0.91 | FYN (0.73) | CYP1B1KDM4EALDH1A1HSD17B10CYP2C19 | |
| SCHEMBL29435863 | 0.87 | CSNK2A2 (0.81) | CYP1A1CYP1B1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL26117897 | 0.87 | CSNK2A2 (0.81) | CYP1A1CYP1B1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL30960382 | 0.87 | TNKS (0.71) | CYP1A1CYP1B1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL1744293 | 0.87 | TNKS (0.71) | CYP1A1CYP1B1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8934614 | 0.86 | KDM4E (0.74) | CYP1A1CYP1B1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL5320080 | 0.85 | KDM4E (0.81) | CYP1A1CYP1B1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8934571 | 0.85 | CSNK2A2 (0.82) | CYP1A1CYP1B1KDM4ECYP2C19CYP2D6 | |
| SCHEMBL6129133 | 0.83 | TUBB4A (0.71) | CYP1A1CYP1B1ALDH1A1CYP3A4AURKA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996031206-A2 | FLAVONES AND COUMARINS AS AGENTS FOR THE TREATMENT OF ATHEROSCLEROSIS | WARNER-LAMBERT COMPANY (US) | 1996-10-10 | — | — | WO | claimed |
| WO-1996031206-A2 | FLAVONES AND COUMARINS AS AGENTS FOR THE TREATMENT OF ATHEROSCLEROSIS | WARNER-LAMBERT COMPANY (US) | 1996-10-10 | — | — | WO | disclosed |