Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 3/20 | 0.53 |
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KDM1A | O60341 | 1/20 | 0.51 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | YARS1 | P54577 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL29382265 | 0.86 | TRPV1 (0.68) | LTA4HTRPV1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL1585964 | 0.86 | TRPV1 (0.68) | LTA4HTRPV1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL2203349 | 0.84 | LTA4H (0.48) | LTA4HTRPV1CYP1A2CYP3A4PTGS1 | |
| SCHEMBL13591710 | 0.82 | TRPV1 (0.76) | TRPV1ALDH1A1CYP1A2CYP3A4PTGS1 | |
| SCHEMBL2208675 | 0.82 | LTA4H (0.56) | LTA4HTRPV1CYP1A2CYP3A4PTGS1 | |
| SCHEMBL17655538 | 0.80 | TRPV1 (0.46) | TRPV1ALDH1A1CYP1A2CYP3A4PTGS1 | |
| SCHEMBL15358922 | 0.78 | TRPV1 (0.58) | LTA4HTRPV1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL15354996 | 0.78 | ACHE (0.56) | TRPV1ALDH1A1CYP1A2CYP3A4PTGS1 | |
| SCHEMBL14329163 | 0.78 | TRPV1 (0.53) | LTA4HTRPV1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL17773568 | 0.76 | TRPV1 (0.73) | TRPV1ALDH1A1CYP1A2CYP3A4PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7981460-B2 | Substituted benzyl ester derivative and use thereof | AJINOMOTO CO., INC. (JP) | 2011-07-19 | — | — | US | disclosed |