Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 2/20 | 0.47 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL5698394 | 1.00 | GRIK1 (0.47) | GRIK1GRIK2CES2CES1NPC1 | |
| SCHEMBL6474115 | 1.00 | GRIK1 (0.47) | GRIK1GRIK2CES2CES1NPC1 | |
| SCHEMBL6474117 | 1.00 | GRIK1 (0.47) | GRIK1GRIK2CES2CES1NPC1 | |
| SCHEMBL6433114 | 0.81 | GRIK1 (0.44) | GRIK1GRIK2CES2CES1NPC1 | |
| SCHEMBL15673252 | 0.80 | GRIK1 (0.47) | GRIK1GRIK2CES2CES1NPC1 | |
| SCHEMBL15673206 | 0.77 | GRIK1 (0.46) | GRIK1GRIK2CES2CES1NPC1 | |
| SCHEMBL111090 | 0.76 | GRIK1 (0.44) | GRIK1GRIK2CES2CES1NPC1 | |
| SCHEMBL1582037 | 0.76 | GRIK1 (0.44) | GRIK1GRIK2CES2CES1NPC1 | |
| SCHEMBL1582039 | 0.76 | GRIK1 (0.44) | GRIK1GRIK2CES2CES1NPC1 | |
| SCHEMBL1245246 | 0.76 | GRIK1 (0.44) | GRIK1GRIK2CES2CES1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1144542-B1 | POLYMER CEMENT ADDITIVE, CEMENT COMPOSITION AND PROCESS THEREWITH | CONOCOPHILLIPS CO (US) | 2006-07-19 | — | — | EP | claimed |
| EP-0337643-A2 | 6-Substituted acrylamido penicillanic acid derivatives, preparation and use | BEECHAM GROUP PLC (GB) | 1989-10-18 | — | — | EP | disclosed |