Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.68 |
| ▸ | LMNA | P02545 | 2/20 | 0.68 |
| ▸ | HTT | P42858 | 1/20 | 0.68 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | CA1 | P00915 | 3/20 | 0.53 |
| ▸ | CA2 | P00918 | 3/20 | 0.53 |
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | CA3 | P07451 | 2/20 | 0.53 |
| ▸ | CA4 | P22748 | 2/20 | 0.53 |
| ▸ | CA6 | P23280 | 2/20 | 0.53 |
| ▸ | CA5A | P35218 | 2/20 | 0.53 |
| ▸ | CA7 | P43166 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.53 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1104955 | 0.82 | SMN1; SMN2 (0.59) | SMN1; SMN2LMNAHTTGAAALDH1A1 | |
| SCHEMBL17907417 | 0.81 | SMN1; SMN2 (1.00) | SMN1; SMN2LMNAHTTGAAALDH1A1 | |
| SCHEMBL7629070 | 0.80 | SMN1; SMN2 (0.80) | SMN1; SMN2LMNAHTTGAAALDH1A1 | |
| SCHEMBL6658719 | 0.79 | ALDH1A1 (0.53) | SMN1; SMN2LMNAHTTALDH1A1CA1 | |
| SCHEMBL4041550 | 0.79 | ALDH1A1 (0.59) | SMN1; SMN2LMNAHTTALDH1A1PKM | |
| SCHEMBL1620820 | 0.79 | SMN1; SMN2 (0.73) | SMN1; SMN2LMNAHTTGAAALDH1A1 | |
| SCHEMBL15303538 | 0.78 | L3MBTL1 (0.50) | SMN1; SMN2LMNAHTTGAAL3MBTL1 | |
| SCHEMBL11514815 | 0.78 | SMN1; SMN2 (0.70) | SMN1; SMN2LMNAHTTGAAALDH1A1 | |
| SCHEMBL507649 | 0.77 | ENPP2 (0.48) | PKM | |
| SCHEMBL7926322 | 0.77 | CA12 (0.60) | SMN1; SMN2LMNAHTTALDH1A1CA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2020404-A1 | Cyanomethyl substituted N-Acyl Tryptamines | Bayer Schering Pharma Aktiengesellschaft (DE) | 2009-02-04 | — | — | EP | disclosed |