Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | TMPRSS4 | Q9NRS4 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | P2RX1 | P51575 | 2/20 | 0.34 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.32 |
| ▸ | HTR3B | O95264 | 1/20 | 0.32 |
| ▸ | PLAU | P00749 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.32 |
| ▸ | HTR3C | Q8WXA8 | 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 | |
|---|---|---|---|---|
| SCHEMBL28836879 | 0.65 | CES2 (0.47) | NQO2TMPRSS4MEN1KMT2AP2RX1 | |
| SCHEMBL27395327 | 0.65 | CES2 (0.52) | TMPRSS4MEN1KMT2AP2RX1P2RX4 | |
| SCHEMBL17141748 | 0.65 | MEN1 (0.43) | NQO2TMPRSS4MEN1KMT2AP2RX1 | |
| SCHEMBL10148475 | 0.65 | PTGS2 (0.35) | NQO2TMPRSS4MEN1KMT2AP2RX1 | |
| SCHEMBL10455842 | 0.63 | MEN1 (0.44) | NQO2TMPRSS4MEN1KMT2AP2RX1 | |
| SCHEMBL130628 | 0.63 | ALDH1A1 (0.59) | TMPRSS4MEN1KMT2ACES2PTGS2 | |
| SCHEMBL320481 | 0.62 | CES2 (0.52) | TMPRSS4MEN1KMT2AP2RX1P2RX4 | |
| SCHEMBL30062195 | 0.62 | CES2 (0.52) | TMPRSS4MEN1KMT2AP2RX1P2RX4 | |
| SCHEMBL10455841 | 0.62 | CES2 (0.52) | NQO2TMPRSS4MEN1KMT2AP2RX1 | |
| SCHEMBL10786191 | 0.62 | ALDH1A1 (0.58) | TMPRSS4MEN1KMT2ACES2PTGS2 |
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-2013030665-A1 | PYRIMIDINES AS SODIUM CHANNEL BLOCKERS | PURDUE PHARMA L.P. (US) | 2013-03-07 | — | — | WO | disclosed |