Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 2/20 | 0.48 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL379205 | 0.79 | GRIK1 (0.64) | GRIK1GRIK2 | |
| SCHEMBL8945452 | 0.77 | GRIK1 (0.45) | GRIK1GRIK2 | |
| SCHEMBL7200824 | 0.77 | GRIK1 (0.50) | GRIK1GRIK2 | |
| SCHEMBL8847145 | 0.73 | GRIK1 (0.52) | GRIK1GRIK2 | |
| SCHEMBL6870462 | 0.73 | — | — | |
| SCHEMBL9861585 | 0.73 | GRIK1 (0.42) | GRIK1GRIK2ALDH1A1 | |
| SCHEMBL19483357 | 0.71 | GRIK1 (0.37) | GRIK1GRIK2 | |
| SCHEMBL19483387 | 0.71 | GRIK1 (0.37) | GRIK1GRIK2 | |
| SCHEMBL7854706 | 0.71 | CA1 (0.42) | GRIK1GRIK2 | |
| SCHEMBL3104177 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6521604-B1 | 1,2-dicarba-closo-dodecarborane containing organic residue; reacting a decaborane with an acetylene; treating tumors | DEUTCHES KREBSFORSCHUNGSZENTRUM (DE) | 2003-02-18 | — | — | US | disclosed |
| EP-1051421-B1 | COMPOUNDS CONTAINING BORON FOR ELECTRON MICROSCOPY AND FOR BORON NEUTRON-CAPTURE THERAPY | DEUTSCHES KREBSFORSCH (DE) | 2002-12-11 | — | — | EP | disclosed |