Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 3/20 | 0.62 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.44 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.44 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9768688 | 0.83 | TAAR1 (0.58) | AOC3OPRM1OPRD1OPRK1TAAR1 | |
| SCHEMBL13937396 | 0.83 | TAAR1 (0.58) | AOC3OPRM1OPRD1OPRK1TAAR1 | |
| SCHEMBL9254668 | 0.81 | OPRM1 (0.57) | AOC3OPRM1OPRD1OPRK1TAAR1 | |
| SCHEMBL13937401 | 0.81 | TAAR1 (0.56) | AOC3OPRM1OPRD1OPRK1TAAR1 | |
| SCHEMBL5669356 | 0.77 | CYP1A2 (0.40) | AOC3CYP1A2 | |
| SCHEMBL20990132 | 0.77 | MAOA (0.55) | OPRM1OPRD1OPRK1TAAR1CYP2A6 | |
| SCHEMBL31420655 | 0.75 | AOC3 (0.46) | AOC3OPRM1OPRD1OPRK1TAAR1 | |
| SCHEMBL13416698 | 0.74 | AOC3 (0.65) | AOC3OPRM1OPRD1OPRK1TAAR1 | |
| SCHEMBL14064920 | 0.73 | AOC3 (0.62) | AOC3OPRM1OPRD1OPRK1TAAR1 | |
| SCHEMBL22340929 | 0.72 | AOC3 (0.58) | AOC3BCHESIGMAR1CYP1A2CYP2D6 |
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-2019183133-A1 | Pan-Tropic Entry Inhibitors | EMORY UNIVERSITY (US) | 2019-09-26 | — | — | WO | disclosed |