Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 10/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13042440 | 0.81 | ALOX5 (0.68) | ALOX5PTGS2CYP3A4TSHRGAA | |
| SCHEMBL12366123 | 0.80 | EPHX2 (0.57) | CYP3A4TSHRGAASMN1; SMN2ALDH1A1 | |
| SCHEMBL10771609 | 0.80 | ALOX5 (0.61) | ALOX5PTGS2CYP3A4TSHRGAA | |
| SCHEMBL21055737 | 0.78 | ALOX5 (0.63) | ALOX5PTGS2CYP3A4TSHRGAA | |
| SCHEMBL30513891 | 0.76 | ALOX5 (0.72) | ALOX5PTGS2CYP3A4TSHRGAA | |
| SCHEMBL22026670 | 0.76 | ALOX5 (0.61) | ALOX5PTGS2CYP3A4TSHRGAA | |
| SCHEMBL1531488 | 0.76 | ALOX5 (0.72) | ALOX5PTGS2CYP3A4TSHRGAA | |
| SCHEMBL9188849 | 0.76 | ALOX5 (0.61) | ALOX5PTGS2CYP3A4TSHRGAA | |
| Hydrochloric Acid SCHEMBL28067312 | 0.76 | ALOX5 (0.61) | ALOX5PTGS2CYP3A4TSHRGAA | |
| SCHEMBL491040 | 0.74 | ALOX5 (0.70) | ALOX5PTGS2CYP3A4TSHRGAA |
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-7998986-B2 | Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors | EXELIXIS PATENT COMPANY LLC (US) | 2011-08-16 | — | — | US | disclosed |