Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 11/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2877230 | 0.91 | CHRM2 (0.51) | OPRM1CHRM3CHRM2SIGMAR1 | |
| SCHEMBL3807589 | 0.90 | MKNK1 (0.39) | OPRM1CHRM3CHRM2NR1I2OPRD1 | |
| SCHEMBL2877239 | 0.88 | NR1I2 (0.42) | OPRM1CHRM3CHRM2SIGMAR1NR1I2 | |
| SCHEMBL2874221 | 0.88 | KDM4E (0.37) | OPRM1CHRM3CHRM2NR1I2 | |
| SCHEMBL2870829 | 0.88 | OPRM1 (0.36) | OPRM1CHRM3CHRM2NR1I2OPRD1 | |
| SCHEMBL2871311 | 0.87 | OPRM1 (0.38) | OPRM1CHRM3CHRM2 | |
| SCHEMBL2880159 | 0.87 | OPRM1 (0.36) | OPRM1CHRM3CHRM2NR1I2KCNH2 | |
| SCHEMBL2873363 | 0.87 | GAA (0.35) | OPRM1CHRM3CHRM2OPRD1 | |
| SCHEMBL2874208 | 0.86 | KDM4E (0.38) | OPRM1NR1I2 | |
| SCHEMBL2877206 | 0.86 | KDM4E (0.38) | OPRM1NR1I2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1569929-B9 | COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS | VIROCHEM PHARMA INC (CA) | 2011-09-14 | — | — | EP | claimed |
| EP-1569929-B1 | COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS | VIROCHEM PHARMA INC (CA) | 2010-05-05 | — | — | EP | claimed |