Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 3/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | SAT1 | P21673 | 1/20 | 0.36 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6916302 | 0.86 | EPHX2 (0.50) | EPHX2PLA2G2CALDH1A1MEN1KMT2A | |
| SCHEMBL15974343 | 0.86 | ALDH1A1 (0.41) | EPHX2CYP2C19CYP1A2KDM1ASAT1 | |
| SCHEMBL3716700 | 0.86 | ALDH1A1 (0.41) | EPHX2CYP2C19CYP1A2KDM1ASAT1 | |
| SCHEMBL20634245 | 0.84 | CYP2C19 (0.52) | CYP2C19CYP1A2KDM1ASAT1ALDH1A1 | |
| SCHEMBL22749468 | 0.83 | ALDH1A1 (0.47) | EPHX2CYP2C19CYP1A2SAT1ALDH1A1 | |
| SCHEMBL30891500 | 0.82 | CYP2C19 (0.52) | LTA4HEPHX2CYP2C19CYP1A2KDM1A | |
| SCHEMBL22749476 | 0.81 | ALDH1A1 (0.44) | EPHX2CYP2C19CYP1A2SAT1ALDH1A1 | |
| SCHEMBL7720909 | 0.80 | ALDH1A1 (0.45) | LTA4HEPHX2ALDH1A1CYP2D6ADRA1A | |
| SCHEMBL13822544 | 0.80 | CYP2C19 (0.57) | EPHX2CYP2C19CYP1A2KDM1ASAT1 | |
| SCHEMBL22835027 | 0.79 | GPR84 (0.55) | EPHX2ALDH1A1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3830093-A1 | BIFUNCTIONAL COMPOUNDS AS CDK MODULATORS | Biotheryx, Inc. (US) | 2021-06-09 | — | — | EP | disclosed |
| WO-2020023782-A1 | BIFUNCTIONAL COMPOUNDS AS CDK MODULATORS | BIOTHERYX, INC. (US) | 2020-01-30 | — | — | WO | disclosed |