Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3886045 | 0.86 | AKR1C3 (0.47) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL27259406 | 0.86 | TDP1 (0.48) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL13316457 | 0.86 | TDP1 (0.48) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL3887994 | 0.85 | CYP1A2 (0.43) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL3887207 | 0.85 | CYP1A2 (0.57) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL1957784 | 0.85 | CYSLTR2 (0.44) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL3890768 | 0.85 | CYSLTR2 (0.44) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL29711483 | 0.85 | CYSLTR2 (0.44) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL3885170 | 0.85 | CYP1A2 (0.57) | CYP1A2GAACYP2C9PKMCYP2C19 | |
| SCHEMBL3573474 | 0.85 | CYP1A2 (0.57) | CYP1A2GAACYP2C9PKMCYP2C19 |
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-2024132001-A1 | MULTITARGET NUCLEAR RECEPTOR LIGANDS BASED ON 2-(4-(QUINOLIN-2-YLOXY)PHENOXY)PROPANOIC ACID AND 2-(4-(QUINOXALIN-2-YLOXY)PHENOXY)PROPANOIC ACID FOR THE TREATMENT OF METABOLIC AND LIVER DISEASES | CHARLES UNIVERSITY, FACULTY OF PHARMACY IN HRADEC KRALOVE (CZ) | 2024-06-27 | — | — | WO | disclosed |