Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | RORC | P51449 | 7/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.41 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6644202 | 0.85 | TSHR (0.50) | BCHETSHRMAPK1AOC3CALM1 | |
| SCHEMBL3029785 | 0.85 | TSHR (0.50) | BCHETSHRMAPK1AOC3CALM1 | |
| SCHEMBL9511821 | 0.85 | BCHE (0.51) | BCHERORCTSHRAOC3SLC6A2 | |
| SCHEMBL14006363 | 0.85 | BCHE (0.51) | BCHERORCTSHRAOC3SLC6A2 | |
| SCHEMBL4747976 | 0.79 | TSHR (0.59) | BCHETSHRMAPK1SLC6A2SLC6A4 | |
| SCHEMBL800998 | 0.79 | POLB (0.54) | BCHERORCTSHRMAPK1AOC3 | |
| SCHEMBL15353863 | 0.78 | TSHR (0.40) | BCHETSHRMAPK1AOC3SLC6A2 | |
| SCHEMBL12039733 | 0.78 | BCHE (0.54) | BCHERORCTSHRAOC3SLC6A2 | |
| SCHEMBL6925154 | 0.78 | TSHR (0.45) | BCHETSHRMAPK1AOC3CALM1 | |
| SCHEMBL23784263 | 0.76 | HRH3 (0.50) | BCHERORCTSHRMAPK1CALM1 |
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-2015182723-A1 | NOVEL PYRROLIDINE COMPOUND AND APPLICATION AS MELANOCORTIN RECEPTOR AGONIST | 田辺三菱製薬株式会社 | 2015-12-03 | — | — | WO | disclosed |