Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | KDM4C | Q9H3R0 | 4/20 | 0.46 |
| ▸ | KDM6B | O15054 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CDK4 | P11802 | 1/20 | 0.42 |
| ▸ | CCND1 | P24385 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL845125 | 0.87 | ALDH1A1 (0.62) | ALDH1A1KDM4EGLAGAAKDM4C | |
| SCHEMBL25827431 | 0.84 | ALDH1A1 (0.58) | ALDH1A1KDM4EGLAGAAKDM4C | |
| SCHEMBL28613135 | 0.82 | ALDH1A1 (0.60) | ALDH1A1KDM4EGLAGAAKDM4C | |
| SCHEMBL23639428 | 0.81 | ALDH1A1 (0.58) | ALDH1A1KDM4EGLAGAAKDM4C | |
| SCHEMBL21786269 | 0.81 | ALDH1A1 (0.63) | ALDH1A1KDM4EGLAGAAKDM4C | |
| SCHEMBL15832960 | 0.79 | ALDH1A1 (0.57) | ALDH1A1KDM4EGLAGAAKDM4C | |
| SCHEMBL29323004 | 0.79 | ALDH1A1 (0.47) | ALDH1A1KDM4EGLAGAAKDM4C | |
| SCHEMBL19838578 | 0.77 | ALDH1A1 (0.54) | ALDH1A1KDM4EGLAGAAKDM4C | |
| SCHEMBL23674679 | 0.77 | ALDH1A1 (0.54) | ALDH1A1KDM4EGLAGAAKDM4C | |
| SCHEMBL29792765 | 0.77 | ALDH1A1 (0.54) | ALDH1A1KDM4EGLAGAAKDM4C |
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-2079690-A2 | 3-AZA-BICYCLO[3.1.0]HEXANE DERIVATIVES | Actelion Pharmaceuticals Ltd. (CH) | 2009-07-22 | — | — | EP | disclosed |
| WO-2008038251-A2 | 3-AZA-BICYCLO[3.1.0]HEXANE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2008-04-03 | — | — | WO | disclosed |