Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.64 |
| ▸ | CA1 | P00915 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | CA4 | P22748 | 1/20 | 0.57 |
| ▸ | CA9 | Q16790 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.50 |
| ▸ | MITF | O75030 | 1/20 | 0.50 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9762959 | 1.00 | CASP3 (0.64) | CASP3CA1CA2CA4CA9 | |
| SCHEMBL3931444 | 0.85 | CASP3 (0.61) | CASP3CA1CA2CA4CA9 | |
| SCHEMBL1142116 | 0.84 | CASP3 (0.86) | CASP3CA1CA2CA4CA9 | |
| SCHEMBL29724090 | 0.84 | CASP3 (0.86) | CASP3CA1CA2CA4CA9 | |
| SCHEMBL19519851 | 0.84 | CASP3 (0.59) | CASP3CA1CA2CA4CA9 | |
| SCHEMBL9762447 | 0.80 | CASP3 (0.48) | CASP3CA1CA2CA4CA9 | |
| SCHEMBL18074272 | 0.80 | CASP3 (0.67) | CASP3CA1CA2CA4CA9 | |
| Dimethylamine SCHEMBL4418548 | 0.78 | CASP3 (0.75) | CASP3CA1CA2CA4CA9 | |
| SCHEMBL13442858 | 0.78 | CASP3 (1.00) | CASP3CA1CA2CA4CA9 | |
| SCHEMBL1065287 | 0.78 | CASP3 (0.65) | CASP3CA1CA2CA4CA9 |
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-0323807-A2 | Certain 2-substituted adenosine derivatives | CIBA-GEIGY AG (CH) | 1989-07-12 | — | — | EP | disclosed |