Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.63 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.56 |
| ▸ | NSD2 | O96028 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | FADS1 | O60427 | 2/20 | 0.51 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.49 |
| ▸ | APEX1 | P27695 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4954215 | 0.83 | PTGS1 (0.67) | HPGDKDM4EALDH1A1PTGS1HSD17B10 | |
| SCHEMBL17744848 | 0.83 | PTGS1 (0.75) | HPGDKDM4EALDH1A1PTGS1HSD17B10 | |
| SCHEMBL5853912 | 0.82 | FFAR1 (0.69) | ALDH1A1PTGS1HSD17B10FADS1FFAR1 | |
| SCHEMBL27483855 | 0.82 | KLKB1 (0.64) | PTGS1FADS1ABCB1ABCG2NPC1 | |
| SCHEMBL2127535 | 0.81 | PTGS1 (0.69) | HPGDKDM4EALDH1A1PTGS1HSD17B10 | |
| SCHEMBL30830441 | 0.81 | PTGS1 (0.69) | HPGDKDM4EALDH1A1PTGS1HSD17B10 | |
| SCHEMBL1140055 | 0.81 | PTGS1 (0.68) | HPGDKDM4EALDH1A1PTGS1HSD17B10 | |
| SCHEMBL27541341 | 0.80 | PTGS1 (0.56) | KDM4EALDH1A1PTGS1FADS1FFAR1 | |
| SCHEMBL2236766 | 0.80 | HPGD (0.77) | HPGDKDM4EALDH1A1NSD2HSD17B10 | |
| SCHEMBL4955884 | 0.79 | GAA (0.67) | HPGDALDH1A1ABCB1ABCG2RAB9A |
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-2008094909-A2 | QUINAZOLINONE AND FUSED PYRIMIDINONE COMPOUNDS AND THEIR USE IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS | XENON PHARMACEUTICALS INC. (CA) | 2008-08-07 | — | — | WO | disclosed |