Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 2/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.33 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.33 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.33 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.33 |
| ▸ | GRIK5 | Q16478 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL27789732 | 0.90 | GRIK1 (0.38) | FAAHGRIK1ALDH1A1KDM4EGRIA1 | |
| SCHEMBL11220812 | 0.79 | NAAA (0.41) | FAAHALDH1A1CES2CES1NAAA | |
| SCHEMBL7048447 | 0.78 | EGLN1 (0.41) | GRIK1ALDH1A1KDM4ECYP2C9GRIA1 | |
| SCHEMBL28052039 | 0.77 | ALDH1A1 (0.41) | GRIK1ALDH1A1CYP2C9LMNANAAA | |
| SCHEMBL4661676 | 0.77 | MGAM (0.45) | GRIK1ALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL15492519 | 0.76 | FAAH (0.51) | FAAHALDH1A1CES2CES1LMNA | |
| SCHEMBL13269286 | 0.74 | ALDH1A1 (0.39) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL3179017 | 0.74 | MAPT (0.38) | GRIK1ALDH1A1KDM4ELMNAMEN1 | |
| SCHEMBL7041913 | 0.73 | GLO1 (0.39) | ALDH1A1KDM4ELMNAMEN1KMT2A | |
| SCHEMBL25547583 | 0.73 | GLO1 (0.39) | ALDH1A1KDM4ELMNAMEN1KMT2A |
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-105418363-A | Synthetic method for 4-tertiary butyl cyclohexaneacetic acid | SHANDONG CHUANCHENG PHARMACEUTICAL CO LTD | 2016-03-23 | — | — | CN | disclosed |