Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5846181 | 0.86 | ALDH1A1 (0.38) | GAATRPA1ALDH1A1KMT2AMEN1 | |
| SCHEMBL6937028 | 0.86 | TRPA1 (0.38) | ESR1TRPA1ALDH1A1LMNAKMT2A | |
| SCHEMBL6939503 | 0.85 | TRPA1 (0.36) | ESR1GAATRPA1KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL5846854 | 0.85 | ALDH1A1 (0.38) | GAATRPA1ALDH1A1KMT2AMEN1 | |
| SCHEMBL10451681 | 0.83 | SLC6A4 (0.45) | GAAKMT2AMEN1SLC6A4SLC6A3 | |
| SCHEMBL10451679 | 0.83 | SLC6A4 (0.45) | GAAKMT2AMEN1SLC6A4SLC6A3 | |
| SCHEMBL10451711 | 0.83 | SLC6A4 (0.45) | GAAKMT2AMEN1SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL10450226 | 0.82 | SLC6A4 (0.44) | GAAKMT2AMEN1SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL10451848 | 0.82 | SLC6A4 (0.44) | GAAKMT2AMEN1SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL10450224 | 0.82 | SLC6A4 (0.44) | GAAKMT2AMEN1SLC6A4SLC6A3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1043307-B1 | 3-amino-3-arylpropan-1-ol-derivates, their preparation and their use | GRUENENTHAL GMBH (DE) | 2003-06-04 | — | — | EP | claimed |
| US-6410790-B1 | ANALGESICS | GRUENENTHAL GMBH (DE) | 2002-06-25 | — | — | US | claimed |
| US-6410790-B1 | ANALGESICS | GRUENENTHAL GMBH (DE) | 2002-06-25 | — | — | US | disclosed |