Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 1/20 | 0.46 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 6/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6660882 | 1.00 | IP6K1 (0.46) | IP6K1IP6K3NFE2L2GRM4PDPK1 | |
| SCHEMBL6663881 | 0.84 | MEN1 (0.47) | IP6K1IP6K3GRM4PDPK1KDM4E | |
| SCHEMBL6663884 | 0.84 | MEN1 (0.47) | IP6K1IP6K3GRM4PDPK1KDM4E | |
| SCHEMBL4065715 | 0.76 | TRPA1 (0.51) | IP6K1IP6K3NFE2L2GRM4KDM4E | |
| SCHEMBL4065710 | 0.76 | TRPA1 (0.51) | IP6K1IP6K3NFE2L2GRM4KDM4E | |
| SCHEMBL31060480 | 0.76 | MKNK1 (0.51) | IP6K1IP6K3PDPK1KDM4EMEN1 | |
| SCHEMBL3468490 | 0.71 | GSK3A (0.53) | KDM4EMAPTKMT2AL3MBTL1GAA | |
| SCHEMBL3468495 | 0.71 | GSK3A (0.53) | KDM4EMAPTKMT2AL3MBTL1GAA | |
| SCHEMBL6662321 | 0.71 | ADORA1 (0.44) | IP6K1IP6K3NFE2L2KDM4EMEN1 | |
| SCHEMBL6662325 | 0.71 | ADORA1 (0.44) | IP6K1IP6K3NFE2L2KDM4EMEN1 |
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-1444982-A1 | The use of purine derivatives as selective kinase inhibitors | MERCKLE GMBH (DE) | 2004-08-11 | — | — | EP | disclosed |