Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.39 |
| ▸ | MOK | Q9UQ07 | 6/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | PIP4K2C | Q8TBX8 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | SMO | Q99835 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19355266 | 0.90 | CYP1A2 (0.43) | USP2CYP1A2CYP3A4CYP2C19CLK4 | |
| SCHEMBL19355476 | 0.90 | FAAH (0.42) | USP2CYP1A2CYP3A4CYP2C19CLK4 | |
| SCHEMBL19355128 | 0.90 | CYP1A2 (0.41) | USP2CYP1A2CYP3A4CYP2C19CLK4 | |
| SCHEMBL19355460 | 0.90 | CYP1A2 (0.44) | USP2CYP1A2CYP3A4CYP2C19CLK4 | |
| SCHEMBL19355473 | 0.88 | CYP1A2 (0.43) | USP2CYP1A2CYP3A4CYP2C19CLK4 | |
| SCHEMBL19355520 | 0.87 | SLC40A1 (0.42) | USP2CYP1A2CYP3A4CYP2C19CLK4 | |
| SCHEMBL19355284 | 0.87 | CYP1A2 (0.50) | USP2CYP1A2CYP3A4CYP2C19CLK4 | |
| SCHEMBL19355281 | 0.86 | CYP1A2 (0.45) | USP2CYP1A2CYP3A4CYP2C19CLK4 | |
| SCHEMBL19905163 | 0.86 | SLC40A1 (0.42) | USP2CYP1A2CYP3A4CYP2C19CLK4 | |
| SCHEMBL19355399 | 0.86 | CYP1A2 (0.42) | USP2CYP1A2CYP3A4CYP2C19CLK4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3057959-B1 | DNA-PK INHIBITORS | VERTEX PHARMA (US) | 2018-02-28 | — | — | EP | disclosed |