Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23027868 | 0.70 | GABRA2 (0.41) | OPRM1SMN1; SMN2RAB9ANPC1CYP1A2 | |
| SCHEMBL835869 | 0.69 | OPRM1 (0.57) | BRD4OPRM1SMN1; SMN2OPRD1OPRK1 | |
| SCHEMBL830705 | 0.69 | OPRM1 (0.57) | BRD4OPRM1SMN1; SMN2OPRD1OPRK1 | |
| SCHEMBL17051307 | 0.68 | SMN1; SMN2 (0.48) | ATMBRD4OPRM1SMN1; SMN2RAB9A | |
| SCHEMBL13036615 | 0.67 | ALDH1A1 (0.41) | ATMSMN1; SMN2CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL9416753 | 0.66 | ALDH1A1 (0.49) | OPRM1SMN1; SMN2RAB9ANPC1CYP1A2 | |
| SCHEMBL28788636 | 0.66 | SMN1; SMN2 (0.46) | OPRM1SMN1; SMN2RAB9ANPC1CYP1A2 | |
| SCHEMBL6315068 | 0.65 | OPRM1 (0.40) | BRD4OPRM1SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL25401575 | 0.65 | ITGB1 (0.48) | ATMBRD4OPRM1SMN1; SMN2RAB9A | |
| SCHEMBL6401268 | 0.65 | OPRM1 (0.40) | BRD4OPRM1SMN1; SMN2RAB9ANPC1 |
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-2018033642-A1 | HETEROCYCLIC LIPXON ANALOGS AND USES THEROF | UNIVERSITY COLLEGE DUBLIN (IE) | 2018-02-22 | — | — | WO | disclosed |