Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11837217 | 0.79 | ALDH1A1 (0.52) | ALOX15POLBALDH1A1SMN1; SMN2HTT | |
| SCHEMBL16083089 | 0.77 | ALDH1A1 (0.50) | ALOX15POLBALDH1A1SMN1; SMN2HTT | |
| SCHEMBL18956020 | 0.75 | ALDH1A1 (0.48) | ALOX15POLBALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL8905148 | 0.75 | ALDH1A1 (0.48) | ALOX15POLBALDH1A1SMN1; SMN2HTT | |
| SCHEMBL27012291 | 0.73 | ALDH1A1 (0.50) | POLBALDH1A1SMN1; SMN2HTTLMNA | |
| SCHEMBL20547329 | 0.73 | ALDH1A1 (0.50) | POLBALDH1A1SMN1; SMN2HTTLMNA | |
| SCHEMBL24414321 | 0.72 | ALDH1A1 (0.48) | POLBALDH1A1SMN1; SMN2HTTLMNA | |
| SCHEMBL5100930 | 0.70 | ALDH1A1 (0.47) | POLBALDH1A1SMN1; SMN2KMT2AHTT | |
| SCHEMBL16083080 | 0.70 | ALDH1A1 (0.47) | POLBALDH1A1SMN1; SMN2KMT2AHTT | |
| SCHEMBL30459460 | 0.68 | ALDH1A1 (0.41) | POLBALDH1A1SMN1; SMN2KMT2AHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021021004-A1 | 3,6,9-TRIAZATRICYCLOTETRADECANE DERIVATIVE AND USE THEREOF FOR TREATING DEPRESSION | Общество с ограниченной ответственностью "Кью Эм Фарма" | 2021-02-04 | — | — | WO | disclosed |
| EP-2088149-A1 | PHARMACOLOGICALLY ACTIVE N,N'-SUBSTITUTED 3,7-DIAZABICYCLO Ý3.3.1¨NONANES, PHARMACEUTICAL COMPOSITIONS BASED THEREON AND A METHOD FOR THE USE THEREOF | Institute of Physiologically active compunds of the Russian Academy of Sciences (IPAC RAN) (RU) | 2009-08-12 | — | — | EP | disclosed |