Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 2/20 | 0.39 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CPA1 | P15085 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL976765 | 1.00 | GRIK1 (0.39) | GRIK1GRIK2CYP2C19CPA1TP53 | |
| SCHEMBL1882200 | 0.80 | FAAH (0.37) | TP53ABCC4MAPTTSHR | |
| SCHEMBL14614018 | 0.80 | GRIK1 (0.34) | GRIK1GRIK2TSHR | |
| SCHEMBL2592558 | 0.79 | TP53 (0.39) | TP53 | |
| SCHEMBL21930777 | 0.79 | GRIK1 (0.41) | GRIK1GRIK2CYP2C19CPA1TP53 | |
| SCHEMBL6076196 | 0.79 | GRIK1 (0.41) | GRIK1GRIK2CYP2C19CPA1TP53 | |
| SCHEMBL11199369 | 0.77 | GRIK1 (0.39) | GRIK1GRIK2CYP2C19CPA1TP53 | |
| SCHEMBL12589962 | 0.76 | GRIK1 (0.44) | GRIK1GRIK2TP53MAPT | |
| SCHEMBL6231134 | 0.76 | GRIK1 (0.44) | GRIK1GRIK2TP53TSHR | |
| SCHEMBL1061282 | 0.76 | GRIK1 (0.44) | GRIK1GRIK2TP53TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-105503815-A | Preparation method of synthetic intermediate of Lipitor | UNIV LANZHOU | 2016-04-20 | — | — | CN | disclosed |