Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 5/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.35 |
| ▸ | LTB4R | Q15722 | 6/20 | 0.35 |
| ▸ | PTGES | O14684 | 4/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4776567 | 0.78 | ALOX5 (0.39) | PPARGALOX5LTB4RPTGESPSEN1 | |
| SCHEMBL4776562 | 0.76 | MMP2 (0.42) | HDAC1HDAC6 | |
| SCHEMBL4776784 | 0.76 | C5AR1 (0.37) | PPARGALOX5ADORA3ADORA1 | |
| SCHEMBL4781761 | 0.72 | LTA4H (0.40) | HDAC1HDAC6 | |
| SCHEMBL4778137 | 0.71 | ALDH1A1 (0.48) | CYP1A2LTB4R | |
| SCHEMBL4778107 | 0.67 | LTB4R (0.48) | CYP1A2CYP3A4CYP2C9ALOX5LTB4R | |
| SCHEMBL4780655 | 0.63 | ALDH1A1 (0.46) | CYP1A2ALOX5PTGES | |
| SCHEMBL14303803 | 0.63 | MAPT (0.46) | CYP2C19 | |
| SCHEMBL4796563 | 0.63 | MMP2 (0.46) | CYP2C19HDAC1HDAC6 | |
| SCHEMBL4778494 | 0.62 | MMP2 (0.45) | HDAC1HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008009963-A2 | PYRIMIDINE DERIVATIVES AS MODULATORS OF PARATHYROID HORMONE RECEPTORS | JAMES BLACK FOUNDATION LIMITED (GB) | 2008-01-24 | — | — | WO | disclosed |