Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CTH | P32929 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14938469 | 1.00 | GAA (0.46) | GAALMNAALDH1A1KDM4ECYP1A2 | |
| SCHEMBL18650100 | 0.82 | ALDH1A1 (0.46) | GAALMNAALDH1A1KDM4ECYP1A2 | |
| SCHEMBL18680191 | 0.75 | KDM4E (0.43) | GAALMNAALDH1A1KDM4ECYP1A2 | |
| SCHEMBL14938464 | 0.73 | RAB9A (0.47) | GAALMNAALDH1A1KDM4ECYP1A2 | |
| SCHEMBL14938462 | 0.73 | RAB9A (0.47) | GAALMNAALDH1A1KDM4ECYP1A2 | |
| SCHEMBL3065930 | 0.72 | RAB9A (0.64) | ALDH1A1KDM4ECYP1A2CYP3A4MAPT | |
| SCHEMBL27178024 | 0.71 | ALDH1A1 (0.53) | GAALMNAALDH1A1KDM4EMAPT | |
| SCHEMBL17666883 | 0.68 | ALDH1A1 (0.47) | LMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL3073524 | 0.68 | ALDH1A1 (0.47) | LMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL965842 | 0.67 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013067646-A1 | PROCESS FOR THE SYNTHESIS OF BETA-AMINOCARBONYLS | UNIVERSITY OF OTTAWA (CA) | 2013-05-16 | — | — | WO | disclosed |