Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX4 | Q99571 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.42 |
| ▸ | CCKBR | P32239 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6595483 | 1.00 | P2RX4 (0.44) | P2RX4OPRM1OPRD1OPRK1CCKBR | |
| SCHEMBL6595493 | 1.00 | P2RX4 (0.44) | P2RX4OPRM1OPRD1OPRK1CCKBR | |
| SCHEMBL6075746 | 0.99 | P2RX4 (0.44) | P2RX4OPRM1OPRD1OPRK1CCKBR | |
| Hydrochloric Acid SCHEMBL6075397 | 0.99 | P2RX4 (0.44) | P2RX4OPRM1OPRD1OPRK1CCKBR | |
| SCHEMBL6075752 | 0.99 | P2RX4 (0.44) | P2RX4OPRM1OPRD1OPRK1CCKBR | |
| SCHEMBL6075755 | 0.99 | P2RX4 (0.44) | P2RX4OPRM1OPRD1OPRK1CCKBR | |
| Hydrochloric Acid SCHEMBL6075394 | 0.99 | P2RX4 (0.44) | P2RX4OPRM1OPRD1OPRK1CCKBR | |
| Hydrochloric Acid SCHEMBL6075388 | 0.99 | P2RX4 (0.44) | P2RX4OPRM1OPRD1OPRK1CCKBR | |
| Hydrochloric Acid SCHEMBL6075712 | 0.86 | OPRM1 (0.40) | OPRM1OPRD1OPRK1CCKBRKDM4E | |
| Hydrochloric Acid SCHEMBL6075708 | 0.86 | OPRM1 (0.40) | OPRM1OPRD1OPRK1CCKBRKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1185526-B1 | NOVEL QUATERNARY AMMONIUM DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL USE | INST NAT SANTE RECH MED (FR) | 2004-09-15 | — | — | EP | disclosed |