Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 3/20 | 0.43 |
| ▸ | GRIK2 | Q13002 | 3/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 2/20 | 0.41 |
| ▸ | THRA | P10827 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 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 | |
|---|---|---|---|---|
| SCHEMBL27644642 | 0.90 | ADRA1A (0.52) | GRIK1GRIK2ADRA2AADRA1ACYP2D6 | |
| SCHEMBL27644165 | 0.88 | TP53 (0.43) | ADRA2AADRA1ACYP2D6MEN1MAPK1 | |
| SCHEMBL28758254 | 0.86 | BCHE (0.41) | GRIK1GRIK2ADRA2AADRA1ACYP2D6 | |
| SCHEMBL4989932 | 0.85 | ADRA1A (0.45) | ADRA2AADRA1ACYP2D6TP53HSD17B10 | |
| SCHEMBL27644169 | 0.83 | MEN1 (0.39) | GRIK1GRIK2CYP2D6MEN1KMT2A | |
| SCHEMBL27665757 | 0.83 | AKR1C3 (0.45) | MEN1MAPK1KMT2ATP53HSD17B10 | |
| SCHEMBL27644290 | 0.82 | GRIK1 (0.41) | GRIK1GRIK2KIF11 | |
| SCHEMBL27665456 | 0.82 | BCHE (0.44) | GRIK1GRIK2ADRA2AADRA1ACYP2D6 | |
| SCHEMBL27665583 | 0.80 | AOC3 (0.44) | GRIK1GRIK2KIF11HSD17B10 | |
| SCHEMBL28815671 | 0.79 | PTGS2 (0.46) | ADRA2AADRA1ACYP2D6MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1886363-A | Amino acids with affinity for the alpha2delta-protein | WARNER LAMBERT CO (US) | 2006-12-27 | — | — | CN | claimed |
| CN-1886363-A | Amino acids with affinity for the alpha2delta-protein | WARNER LAMBERT CO (US) | 2006-12-27 | — | — | CN | disclosed |