Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.56 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.55 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | FADS1 | O60427 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CASP3 | P42574 | 1/20 | 0.49 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.49 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.47 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4960584 | 0.95 | PTGS1 (0.60) | PTGS1P2RX1GRM4KDM4EFADS1 | |
| SCHEMBL5668547 | 0.83 | PTGS1 (0.68) | PTGS1P2RX1GRM4KDM4EFADS1 | |
| SCHEMBL5900421 | 0.82 | PTGS1 (0.63) | PTGS1P2RX1FADS1NPC1RAB9A | |
| SCHEMBL4960684 | 0.81 | P2RX1 (0.59) | P2RX1GRM4KDM4ERAB9AALDH1A1 | |
| SCHEMBL4960692 | 0.81 | P2RX1 (0.59) | P2RX1GRM4KDM4ERAB9AALDH1A1 | |
| SCHEMBL31582888 | 0.81 | FADS1 (0.67) | PTGS1P2RX1GRM4FADS1NPC1 | |
| SCHEMBL4033804 | 0.81 | FADS1 (0.67) | PTGS1P2RX1GRM4FADS1NPC1 | |
| SCHEMBL5665935 | 0.80 | FADS1 (0.66) | PTGS1P2RX1GRM4FADS1RAB9A | |
| SCHEMBL1011998 | 0.80 | MAPT (0.67) | PTGS1P2RX1FADS1NPC1RAB9A | |
| SCHEMBL5668564 | 0.78 | PTGS1 (0.64) | PTGS1P2RX1GRM4FADS1NPC1 |
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 |