Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 2/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.41 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.40 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 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 | |
|---|---|---|---|---|
| SCHEMBL10734570 | 0.90 | TDP1 (0.48) | BCHEKMT2AL3MBTL1NR1H2NR1H3 | |
| Hydrochloric Acid SCHEMBL9455015 | 0.82 | NR1H2 (0.45) | KMT2AL3MBTL1NR1H2NR1H3SIGMAR1 | |
| SCHEMBL8374276 | 0.82 | ALDH1A1 (0.47) | BCHEKMT2AL3MBTL1SIGMAR1CYP4F2 | |
| SCHEMBL5326433 | 0.79 | BCHE (0.53) | BCHEKMT2ANR1H2NR1H3SIGMAR1 | |
| SCHEMBL10693193 | 0.78 | SIGMAR1 (0.51) | KMT2AL3MBTL1NR1H2NR1H3SIGMAR1 | |
| SCHEMBL7027687 | 0.77 | CYP4F2 (0.50) | BCHEKMT2AL3MBTL1SIGMAR1CYP4F2 | |
| SCHEMBL10907115 | 0.77 | ALDH1A1 (0.55) | KMT2AL3MBTL1NR1H2NR1H3CRHBP | |
| SCHEMBL26985832 | 0.76 | AOC3 (0.50) | SIGMAR1AOC3SLC6A2SLC6A4MTNR1A | |
| SCHEMBL15618416 | 0.76 | BCHE (0.49) | BCHEKMT2AL3MBTL1SIGMAR1CYP4F2 | |
| SCHEMBL642317 | 0.75 | CRHBP (0.61) | NR1H2NR1H3AOC3CRHBPCRHR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1397129-A1 | HETEROARYLOXY 3-SUBSTITUTED PROPANAMINES S SEROTONIN AND NOREPINEPHRINE REUPTAKE INHIBITORS | ELI LILLY AND COMPANY (US) | 2004-03-17 | — | — | EP | disclosed |
| WO-2002094262-A1 | HETEROARYLOXY 3-SUBSTITUTED PROPANAMINES S SEROTONIN AND NOREPINEPHRINE REUPTAKE INHIBITORS | ELI LILLY AND COMPANY (US) | 2002-11-28 | — | — | WO | disclosed |