Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 3/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.35 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 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 | |
|---|---|---|---|---|
| SCHEMBL20977970 | 0.86 | KDM1A (0.47) | OPRM1OPRD1SLC6A2SLC6A4GABRD | |
| SCHEMBL14744167 | 0.79 | PARP1 (0.44) | PARP10OPRM1OPRD1CYP2D6OPRK1 | |
| SCHEMBL23332933 | 0.79 | MAPK14 (0.40) | OPRM1OPRD1CYP2D6OPRK1KCNH2 | |
| SCHEMBL2168318 | 0.78 | CYP19A1 (0.41) | PARP10CYP2C9PARP2CA1CA2 | |
| SCHEMBL8042316 | 0.75 | DRD2 (0.55) | KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3246807 | 0.74 | TACR1 (0.56) | OPRM1KCNH2SLC6A4 | |
| Hydrochloric Acid SCHEMBL23858290 | 0.73 | DRD2 (0.53) | KCNH2SLC6A2SLC6A4SLC6A3 | |
| Ammonia Solution, Strong SCHEMBL7048227 | 0.73 | TACR1 (0.40) | OPRM1CYP2D6KCNH2SLC6A2SLC6A4 | |
| Formic Acid SCHEMBL28511334 | 0.73 | OPRM1 (0.49) | OPRM1KCNH2SLC6A4POLB | |
| Hydrochloric Acid SCHEMBL1513382 | 0.73 | TACR1 (0.54) | OPRM1KCNH2SLC6A4 |
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-3480198-A1 | NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | RIKEN (JP) | 2019-05-08 | — | — | EP | disclosed |