Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB2 | Q96IY4 | 8/20 | 0.56 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.52 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.52 |
| ▸ | GSR | P00390 | 1/20 | 0.48 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.47 |
| ▸ | CPA1 | P15085 | 1/20 | 0.46 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10785041 | 0.98 | CPB2 (0.59) | CPB2GRIK1GRIK2GSRRNPEP | |
| SCHEMBL6834831 | 0.94 | CPB2 (0.57) | CPB2GRIK1GRIK2GSRRNPEP | |
| SCHEMBL13258636 | 0.86 | GRIK1 (0.57) | CPB2GRIK1GRIK2GSRRNPEP | |
| SCHEMBL14518785 | 0.86 | GRIK1 (0.57) | CPB2GRIK1GRIK2GSRRNPEP | |
| SCHEMBL11795592 | 0.82 | ABCC4 (0.50) | GRIK1GRIK2CPA1CYP2D6NFKB1 | |
| SCHEMBL11796940 | 0.81 | ABCC4 (0.53) | GRIK1GRIK2CPA1CYP2D6NFKB1 | |
| SCHEMBL11784979 | 0.81 | ABCC4 (0.53) | GRIK1GRIK2CPA1CYP2D6NFKB1 | |
| SCHEMBL11753937 | 0.81 | MAPT (0.53) | CPB2GRIK1GRIK2CPA1TBXAS1 | |
| SCHEMBL16041974 | 0.81 | MAPT (0.53) | CPB2GRIK1GRIK2CPA1TBXAS1 | |
| SCHEMBL9733024 | 0.81 | GRIK1 (0.52) | CPB2GRIK1GRIK2CPA1TBXAS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1062203-B2 | PROCESS FOR THE CONTINUOUS PURIFICATION OF CRUDE EPSILON-CAPROLACTAM | DSM IP ASSETS BV (NL) | 2009-10-21 | — | — | EP | claimed |
| EP-1335904-B1 | PRODUCTION OF ALKYL 6-AMINOCAPROATE | INVISTA TECH SARL (US) | 2006-03-08 | — | — | EP | claimed |
| EP-1062203-B1 | PROCESS FOR THE CONTINUOUS PURIFICATION OF CRUDE EPSILON-CAPROLACTAM | DSM NV (NL) | 2002-07-03 | — | — | EP | claimed |