Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.76 |
| ▸ | HTT | P42858 | 7/20 | 0.54 |
| ▸ | LMNA | P02545 | 6/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4350067 | 0.96 | SMN1; SMN2 (0.70) | SMN1; SMN2HTTLMNAALDH1A1GAA | |
| SCHEMBL27782800 | 0.83 | POLB (0.61) | SMN1; SMN2HTTLMNAALDH1A1RECQL | |
| SCHEMBL27761069 | 0.83 | HTT (0.62) | SMN1; SMN2HTTLMNAALDH1A1GAA | |
| SCHEMBL16320691 | 0.81 | SMN1; SMN2 (0.89) | SMN1; SMN2HTTLMNAALDH1A1GAA | |
| SCHEMBL4355850 | 0.79 | SMN1; SMN2 (0.58) | SMN1; SMN2HTTLMNAALDH1A1GAA | |
| SCHEMBL4349349 | 0.79 | EPHX2 (0.62) | SMN1; SMN2HTTLMNAALDH1A1L3MBTL1 | |
| SCHEMBL4355894 | 0.79 | NPC1 (0.79) | SMN1; SMN2HTTLMNAALDH1A1GAA | |
| SCHEMBL4356036 | 0.79 | HTT (0.60) | SMN1; SMN2HTTLMNAALDH1A1RECQL | |
| SCHEMBL27761072 | 0.78 | SMN1; SMN2 (0.57) | SMN1; SMN2HTTLMNAALDH1A1GAA | |
| SCHEMBL4341540 | 0.75 | MEN1 (0.62) | SMN1; SMN2HTTLMNAALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-100546977-C | Suppress the new compound and the application thereof of rotamase | JERINI AG (DE) | 2009-10-07 | — | — | CN | claimed |