Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP1 | P22413 | 3/20 | 0.51 |
| ▸ | USP2 | O75604 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | RPS6KB1 | P23443 | 5/20 | 0.41 |
| ▸ | AURKA | O14965 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30105949 | 1.00 | ENPP1 (0.51) | ENPP1USP2CYP1A2CYP2D6CLK4 | |
| SCHEMBL30583764 | 0.91 | ENPP1 (0.47) | ENPP1USP2CYP1A2CYP2D6CLK4 | |
| SCHEMBL30105932 | 0.91 | ENPP1 (0.47) | ENPP1USP2CYP1A2CYP2D6CLK4 | |
| SCHEMBL28926218 | 0.86 | ENPP1 (0.44) | ENPP1USP2CYP1A2CYP2D6CLK4 | |
| SCHEMBL28926217 | 0.84 | USP2 (0.44) | ENPP1USP2CYP1A2CYP2D6CLK4 | |
| SCHEMBL30105914 | 0.82 | CYP1A2 (0.50) | ENPP1USP2CYP1A2CYP2D6CLK4 | |
| SCHEMBL28926173 | 0.82 | CYP1A2 (0.50) | ENPP1USP2CYP1A2CYP2D6CLK4 | |
| SCHEMBL30105894 | 0.78 | USP2 (0.46) | ENPP1USP2CYP1A2CYP2D6CLK4 | |
| SCHEMBL30105970 | 0.75 | USP2 (0.49) | USP2CYP1A2CYP2D6CLK4CYP3A4 | |
| SCHEMBL28926188 | 0.75 | USP2 (0.49) | USP2CYP1A2CYP2D6CLK4CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115536696-B | ENPP1 inhibitors | 上海齐鲁制药研究中心有限公司 | 2023-07-14 | — | — | CN | disclosed |
| CN-115536696-A | ENPP1 inhibitors | 上海齐鲁制药研究中心有限公司 | 2022-12-30 | — | — | CN | disclosed |