Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 4/20 | 0.49 |
| ▸ | CA1 | P00915 | 3/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | DHODH | Q02127 | 1/20 | 0.47 |
| ▸ | S100B | P04271 | 3/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | BLM | P54132 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | THRB | P10828 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | CASP6 | P55212 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7514613 | 1.00 | SIRT2 (0.58) | SIRT2CA2CA1CA9CA12 | |
| SCHEMBL27599235 | 0.84 | SIRT2 (0.50) | SIRT2CA2CA1CA9CA12 | |
| SCHEMBL29558987 | 0.81 | PTGS2 (0.51) | SIRT2CA2CA1CA9CA12 | |
| SCHEMBL7883092 | 0.81 | PTGS2 (0.51) | SIRT2CA2CA1CA9CA12 | |
| SCHEMBL7883088 | 0.81 | PTGS2 (0.51) | SIRT2CA2CA1CA9CA12 | |
| SCHEMBL30301787 | 0.81 | SIRT2 (0.88) | SIRT2CA2CA1CA9CA12 | |
| SCHEMBL10620538 | 0.81 | SIRT2 (0.88) | SIRT2CA2CA1CA9CA12 | |
| SCHEMBL10620536 | 0.81 | SIRT2 (0.88) | SIRT2CA2CA1CA9CA12 | |
| SCHEMBL7516086 | 0.81 | CA2 (0.46) | SIRT2CA2CA1CA9CA12 | |
| SCHEMBL7516083 | 0.81 | CA2 (0.46) | SIRT2CA2CA1CA9CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-20020032262-A1 | 2-aminoarylmethylamine solid support templated for preparation of highly functionalized heterocycle compounds | ZHANG JINFANG (US) | 2002-03-14 | — | — | US | disclosed |