Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | ACHE | P22303 | 3/20 | 0.51 |
| ▸ | PLK1 | P53350 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.50 |
| ▸ | GABRP | O00591 | 1/20 | 0.50 |
| ▸ | GABRD | O14764 | 1/20 | 0.50 |
| ▸ | KDM1A | O60341 | 1/20 | 0.50 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.50 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.50 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.50 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.50 |
| ▸ | CCNC | P24863 | 1/20 | 0.50 |
| ▸ | CDK2 | P24941 | 1/20 | 0.50 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.50 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.50 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL27747646 | 0.81 | ACHE (0.69) | ACHEPLK1BACE1PKMGABRP | |
| SCHEMBL8934583 | 0.80 | ACHE (0.54) | ACHEPLK1BACE1PKMGABRP | |
| SCHEMBL30738943 | 0.79 | ACHE (0.73) | CYP2D6ACHEPLK1BACE1PKM | |
| SCHEMBL8934550 | 0.79 | KDM4E (0.66) | ACHEPLK1BACE1PKMGABRP | |
| SCHEMBL4783697 | 0.75 | ALDH1A1 (0.67) | CYP2D6ACHEPLK1BACE1PKM | |
| SCHEMBL30662542 | 0.71 | ACHE (0.66) | ACHEPLK1BACE1PKMGABRP | |
| SCHEMBL27907984 | 0.71 | ACHE (0.66) | ACHEPLK1BACE1PKMGABRP | |
| SCHEMBL8934562 | 0.70 | MEN1 (0.67) | CYP2D6ACHEPLK1BACE1PKM | |
| Water SCHEMBL27796668 | 0.70 | CREB1 (0.71) | CYP2D6PLK1PKMGABRPGABRD | |
| Isowogonin SCHEMBL28012275 | 0.69 | ACHE (0.79) | ACHEPLK1BACE1PKMGABRP |
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 |