Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.55 |
| ▸ | MAOB | P27338 | 3/20 | 0.52 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.51 |
| ▸ | MME | P08473 | 1/20 | 0.51 |
| ▸ | ACE | P12821 | 1/20 | 0.51 |
| ▸ | CPA1 | P15085 | 1/20 | 0.51 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.51 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | PTGES | O14684 | 1/20 | 0.48 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.47 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL19857059 | 1.00 | KMT2A (0.56) | KMT2ASMN1; SMN2ALOX5MAOBNR4A2 | |
| SCHEMBL23747953 | 0.88 | ALOX5 (0.56) | KMT2ASMN1; SMN2ALOX5MAOBNR4A2 | |
| SCHEMBL16825380 | 0.88 | ALOX5 (0.56) | KMT2ASMN1; SMN2ALOX5MAOBNR4A2 | |
| SCHEMBL2505640 | 0.84 | PSEN1 (0.44) | KMT2ASMN1; SMN2ALOX5MAOBMME | |
| SCHEMBL2505243 | 0.84 | PSEN1 (0.44) | KMT2ASMN1; SMN2ALOX5MAOBMME | |
| SCHEMBL16871046 | 0.84 | BCHE (0.53) | KMT2ASMN1; SMN2ALOX5MAOBNR4A2 | |
| SCHEMBL16871064 | 0.84 | BCHE (0.53) | KMT2ASMN1; SMN2ALOX5MAOBNR4A2 | |
| SCHEMBL15474062 | 0.83 | ALOX5 (0.55) | KMT2ASMN1; SMN2ALOX5PTGES | |
| SCHEMBL18371748 | 0.83 | BCHE (0.53) | KMT2ASMN1; SMN2ALOX5MAOBNR4A2 | |
| SCHEMBL29763585 | 0.83 | BCHE (0.53) | KMT2ASMN1; SMN2ALOX5MAOBNR4A2 |
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-2943454-B1 | TAPENTADOL MALEATE AND CRYSTALLINE FORMS THEREOF | KRKA TOVARNA ZDRAVIL D D (SI) | 2021-08-18 | — | — | EP | disclosed |
| EP-3083551-B1 | CRYSTALLINE FORM OF TAPENTADOL INTERMEDIATE | FARMA GRS D O O (SI) | 2018-02-14 | — | — | EP | disclosed |
| CN-103339116-B | Substituted n-valeramide compound, preparation method and application thereof | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2016-04-06 | — | — | CN | disclosed |