Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 7/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.48 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | PLD1 | Q13393 | 6/20 | 0.48 |
| ▸ | OPRL1 | P41146 | 4/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.47 |
| ▸ | PLD2 | O14939 | 4/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1833680 | 0.91 | OPRM1 (0.51) | KDM4EALDH1A1PMP22NPSR1OPRM1 | |
| SCHEMBL1836553 | 0.90 | KDM4E (0.49) | KDM4EALDH1A1PMP22NPSR1OPRM1 | |
| SCHEMBL4679191 | 0.88 | OPRM1 (0.53) | KDM4EALDH1A1PMP22NPSR1OPRM1 | |
| SCHEMBL1837643 | 0.86 | OPRM1 (0.50) | KDM4EALDH1A1PMP22NPSR1OPRM1 | |
| SCHEMBL1839281 | 0.86 | CYP3A4 (0.49) | KDM4EALDH1A1PMP22NPSR1OPRM1 | |
| SCHEMBL1839221 | 0.86 | OPRM1 (0.53) | KDM4EALDH1A1PMP22NPSR1OPRM1 | |
| SCHEMBL1831375 | 0.86 | OPRM1 (0.52) | KDM4EALDH1A1PMP22NPSR1OPRM1 | |
| SCHEMBL1836588 | 0.86 | OPRM1 (0.51) | KDM4EALDH1A1PMP22NPSR1OPRM1 | |
| SCHEMBL1833973 | 0.85 | OPRM1 (0.46) | KDM4EALDH1A1PMP22NPSR1OPRM1 | |
| SCHEMBL1836056 | 0.84 | OPRM1 (0.55) | ALDH1A1OPRM1PLD1OPRL1OPRK1 |
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-1997805-A1 | Compounds with antiparasitic activity, applications thereof to the treatment of infectious diseases caused by apicomplexans | Commissariat à l'Energie Atomique (FR) | 2008-12-03 | — | — | EP | disclosed |