Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 5/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.31 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20177916 | 1.00 | OPRL1 (0.37) | OPRL1HTR2AHTR2CHTR2BPROKR1 | |
| SCHEMBL20177747 | 0.84 | KDM1A (0.36) | — | |
| SCHEMBL20177482 | 0.83 | FPR2 (0.31) | — | |
| SCHEMBL20177930 | 0.80 | ADRA1A (0.42) | PROKR1CYP1A2 | |
| SCHEMBL20177548 | 0.80 | ADRA1A (0.42) | PROKR1CYP1A2 | |
| SCHEMBL20177923 | 0.73 | HTR2A (0.43) | OPRL1HTR2AHTR2CHTR2BPROKR1 | |
| SCHEMBL20177787 | 0.70 | FPR2 (0.46) | — | |
| SCHEMBL20177526 | 0.70 | FPR2 (0.46) | — | |
| SCHEMBL20177610 | 0.68 | BRD4 (0.41) | CYP1A2 | |
| SCHEMBL20177535 | 0.68 | BRD4 (0.41) | CYP1A2 |
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-2018092916-A1 | NITROGEN-CONTAINING POLYCYCLIC HETEROCYCLIC DERIVATIVE | 宇部興産株式会社 | 2018-05-24 | — | — | WO | disclosed |