Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 3/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.36 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.36 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL8504875 | 0.71 | SMN1; SMN2 (0.50) | CYP1A2CYP3A4RECQLMAPTMAPK1 | |
| SCHEMBL14923232 | 0.71 | KIF11 (0.45) | L3MBTL1TDP1CYP1A2MAPT | |
| SCHEMBL28403655 | 0.70 | POLB (0.42) | POLBSLC1A3SLC1A2SLC1A1CYP1A2 | |
| SCHEMBL28403656 | 0.70 | POLB (0.42) | POLBSLC1A3SLC1A2SLC1A1CYP1A2 | |
| SCHEMBL10305545 | 0.69 | OPRM1 (0.39) | OPRM1OPRD1OPRK1CHRM2CHRM1 | |
| SCHEMBL8059176 | 0.69 | OPRM1 (0.38) | OPRM1OPRD1OPRK1CHRM2CHRM1 | |
| SCHEMBL8058563 | 0.68 | GRM2 (0.39) | OPRM1OPRD1OPRK1CHRM2CHRM1 | |
| SCHEMBL10806221 | 0.67 | OPRM1 (0.42) | OPRM1OPRD1OPRK1L3MBTL1POLB | |
| Acetic Acid SCHEMBL27477992 | 0.67 | LMNA (0.52) | OPRM1OPRD1OPRK1L3MBTL1GRM5 | |
| SCHEMBL27788552 | 0.67 | OPRM1 (0.42) | OPRM1OPRD1OPRK1L3MBTL1POLB |
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-2153832-B1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2016-03-09 | — | — | EP | disclosed |