Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.40 |
| ▸ | TOP2A | P11388 | 3/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | NSD2 | O96028 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4259573 | 0.84 | RAB9A (0.47) | CASP3CA12CA2CA9PTPRC | |
| SCHEMBL4427147 | 0.72 | KDM4E (0.47) | ALDH1A1ADRA1DADRA1AADRA1BMAPT | |
| SCHEMBL627775 | 0.72 | TDO2 (0.62) | TOP2ASMN1; SMN2HTT | |
| SCHEMBL13442855 | 0.69 | CASP3 (1.00) | CASP3CA12CA2CA9ALDH1A1 | |
| SCHEMBL23422825 | 0.68 | TOP2A (0.56) | PTPRCALDH1A1TOP2AMAPTNPC1 | |
| SCHEMBL31377051 | 0.67 | CASP3 (0.85) | CASP3CA12CA2CA9ALDH1A1 | |
| SCHEMBL170913 | 0.67 | CASP3 (0.85) | CASP3CA12CA2CA9ALDH1A1 | |
| Anthraquinone SCHEMBL8517968 | 0.66 | KMT2A (0.57) | CASP3PTPRCALDH1A1MAPTNPC1 | |
| Methane SCHEMBL4623788 | 0.66 | CASP3 (0.82) | CASP3CA12CA2CA9ALDH1A1 | |
| SCHEMBL23422823 | 0.66 | IDO1 (0.48) | CASP3PTPRCALDH1A1RAB9ALMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012021409-A3 | Anthraquinone Analogs | UTAH STATE UNIVERSITY (US) | 2012-05-24 | — | — | WO | disclosed |
| WO-2012021409-A2 | Anthraquinone Analogs | UTAH STATE UNIVERSITY (US) | 2012-02-16 | — | — | WO | disclosed |
| WO-2012021409-A2 | Anthraquinone Analogs | UTAH STATE UNIVERSITY (US) | 2012-02-16 | — | — | WO | disclosed |