Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | P4HB | P07237 | 2/20 | 0.36 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | VNN1 | O95497 | 3/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20037381 | 0.78 | HDAC8 (0.43) | SMN1; SMN2 | |
| SCHEMBL21666075 | 0.75 | ALDH1A1 (0.32) | KDM4E | |
| SCHEMBL14525170 | 0.75 | TDP1 (0.35) | HSD17B10KDM4ESMN1; SMN2 | |
| SCHEMBL24726650 | 0.74 | KAT6A (0.38) | HSD17B10KDM4EHTTSMN1; SMN2 | |
| SCHEMBL14821933 | 0.70 | GSK3B (0.51) | GSK3BGRM5ENPP2P4HBGPR139 | |
| SCHEMBL4470152 | 0.69 | GRM5 (0.48) | GSK3BGRM5ENPP2P4HBGPR139 | |
| SCHEMBL3819152 | 0.69 | GRM5 (0.58) | GSK3BGRM5GPR139S1PR3IRAK4 | |
| SCHEMBL12154031 | 0.69 | GSK3B (0.47) | GSK3BGRM5ENPP2GPR139VNN1 | |
| SCHEMBL11808658 | 0.69 | GSK3B (0.55) | GSK3BGRM5ENPP2P4HBGPR139 | |
| SCHEMBL4083136 | 0.68 | GSK3B (0.58) | GSK3BGRM5ENPP2P4HBS1PR3 |
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-3604308-A1 | SUBSTITUTED BICYCLIC DIHYDROPYRIMIDINONES AND THEIR USE AS INHIBITORS OF NEUTROPHIL ELASTASE ACTIVITY | Boehringer Ingelheim International GmbH (DE) | 2020-02-05 | — | — | EP | disclosed |