Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 8/20 | 0.44 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 5/20 | 0.34 |
| ▸ | TYK2 | P29597 | 5/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10049030 | 0.95 | BTK (0.46) | BTKJAK2TYK2KDM1AKDR | |
| SCHEMBL12469516 | 0.81 | GRM2 (0.40) | BTKGRM5GRM2KDRPDE3B | |
| SCHEMBL12469765 | 0.81 | AURKA (0.40) | BTKGRM5GRM2KDR | |
| SCHEMBL12469667 | 0.79 | BTK (0.43) | BTKGRM2PDE3BPDE3A | |
| SCHEMBL12469271 | 0.78 | NISCH (0.43) | BTKGRM2 | |
| SCHEMBL12469609 | 0.78 | BTK (0.39) | BTKGRM2KDRPDE3BPDE3A | |
| SCHEMBL12469700 | 0.77 | BTK (0.40) | BTKGRM5GRM2KDRPDE3B | |
| SCHEMBL12469562 | 0.77 | BTK (0.42) | BTKGRM2KDR | |
| SCHEMBL12469647 | 0.77 | BTK (0.38) | BTKGRM5GRM2PDE3BPDE3A | |
| SCHEMBL12469863 | 0.76 | BTK (0.42) | BTKGRM2TYK2PDE3BPDE3A |
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-2012047017-A2 | 2,3-DIHYDRO-ISOINDOL-1-ONE DERIVATIVE AND A COMPOSITION COMPRISING THE SAME | 크리스탈지노믹스(주) (KR) | 2012-04-12 | — | — | WO | disclosed |