Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 6/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.40 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20049886 | 0.85 | PSMB5 (0.42) | MKNK2GRM5GSK3AGSK3B | |
| SCHEMBL20049970 | 0.81 | GRM5 (0.43) | PDGFRBPDGFRAGRM5ALDH1A1GSK3A | |
| SCHEMBL25588074 | 0.80 | CHRNA7 (0.38) | PDGFRBPDGFRAGRM5CYP1A2ALDH1A1 | |
| SCHEMBL20049984 | 0.80 | ESR2 (0.47) | GRM5 | |
| SCHEMBL25588429 | 0.78 | GRIN1 (0.35) | ALDH1A1 | |
| SCHEMBL20049992 | 0.77 | CNR1 (0.39) | CYP3A4CYP1A2ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL20049908 | 0.77 | CYP1A2 (0.40) | CYP3A4CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL20049775 | 0.77 | NPC1 (0.42) | PDGFRBPDGFRAALDH1A1 | |
| SCHEMBL20049842 | 0.76 | NEK1 (0.43) | GRM5GSK3A | |
| SCHEMBL20049967 | 0.76 | ALDH1A1 (0.52) | ALDH1A1 |
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-2018067786-A1 | SUBSTITUTED 1H-IMIDAZO[4,5-B]PYRIDIN-2(3H)-ONES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2018-04-12 | — | — | WO | disclosed |