Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.52 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6238315 | 1.00 | ALDH1A1 (0.59) | ALDH1A1KEAP1FFAR1TDP1HDAC2 | |
| SCHEMBL5808516 | 0.88 | FFAR1 (0.58) | ALDH1A1FFAR1HDAC2HDAC1HTT | |
| SCHEMBL20845697 | 0.83 | ALDH1A1 (0.55) | ALDH1A1KEAP1FFAR1TDP1HDAC2 | |
| SCHEMBL22375194 | 0.83 | ALDH1A1 (0.55) | ALDH1A1KEAP1FFAR1TDP1HDAC2 | |
| SCHEMBL20845698 | 0.83 | ALDH1A1 (0.55) | ALDH1A1KEAP1FFAR1TDP1HDAC2 | |
| SCHEMBL29408009 | 0.83 | ALDH1A1 (0.55) | ALDH1A1KEAP1FFAR1TDP1HDAC2 | |
| SCHEMBL4824729 | 0.83 | ALDH1A1 (0.55) | ALDH1A1KEAP1FFAR1TDP1HDAC2 | |
| SCHEMBL21486330 | 0.81 | ALDH1A1 (0.53) | ALDH1A1KEAP1FFAR1TDP1HDAC2 | |
| SCHEMBL29572084 | 0.81 | ALDH1A1 (0.53) | ALDH1A1KEAP1FFAR1TDP1HDAC2 | |
| SCHEMBL1977888 | 0.81 | ALDH1A1 (0.53) | ALDH1A1KEAP1FFAR1TDP1HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100368414-C | Morphinan derivatives, their quaternary ammonium salts substituted at position 14, process for their preparation and their use | HELMUT SCHMIDHAMMER (AT) | 2008-02-13 | — | — | CN | disclosed |
| CN-1665819-A | Morphinan derivatives the quaternary ammonium salts thereof substituted in position 14, method for production and use thereof | HELMUT SCHMIDHAMMER (AT) | 2005-09-07 | — | — | CN | disclosed |