Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.34 |
| ▸ | BACE1 | P56817 | 5/20 | 0.34 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.33 |
| ▸ | CARM1 | Q86X55 | 5/20 | 0.33 |
| ▸ | PRMT6 | Q96LA8 | 5/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | DRD5 | P21918 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 3/20 | 0.32 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.32 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16795329 | 0.88 | ALDH1A1 (0.43) | ALDH1A1TSHRCYP2D6 | |
| SCHEMBL16795221 | 0.86 | HRH3 (0.40) | ACHEBACE1CARM1PRMT6BCHE | |
| SCHEMBL18580408 | 0.82 | LPL (0.47) | ACHEBACE1MAP4K4CARM1PRMT6 | |
| SCHEMBL18580127 | 0.82 | LPL (0.46) | ACHEBACE1CARM1PRMT6BCHE | |
| SCHEMBL16795407 | 0.78 | KDM4E (0.44) | MAP4K4ALDH1A1TSHR | |
| SCHEMBL16795229 | 0.75 | CXCR3 (0.36) | ACHEBACE1BCHEALDH1A1 | |
| SCHEMBL16795291 | 0.75 | CARM1 (0.47) | ACHEBACE1PDGFRBKDRMAP4K4 | |
| SCHEMBL16795129 | 0.70 | MAOB (0.36) | DRD2ALDH1A1 | |
| SCHEMBL18579622 | 0.69 | LIPG (0.48) | ACHEBACE1MAP4K4CARM1PRMT6 | |
| SCHEMBL18579621 | 0.69 | LIPG (0.48) | ACHEBACE1MAP4K4CARM1PRMT6 |
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-2015086693-A1 | PYRAZOLOPYRIMIDIN-2-YL DERIVATIVES AS JAK INHIBITORS | ALMIRALL, S.A. (ES) | 2015-06-18 | — | — | WO | disclosed |