Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA4 | P22748 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA6 | P23280 | 2/20 | 0.43 |
| ▸ | CA5A | P35218 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.43 |
| ▸ | SNCA | P37840 | 1/20 | 0.43 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.43 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.43 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27861984 | 0.95 | ALOX5 (0.48) | ESR1ALOX5THRBTRPV1 | |
| SCHEMBL1405663 | 0.87 | KDM4E (0.46) | ESR1KDM4ECA1CA2CA4 | |
| SCHEMBL29009291 | 0.85 | HTR1A (0.48) | ESR1ALOX5HTR1AMEN1KMT2A | |
| SCHEMBL26046329 | 0.85 | CA1 (0.46) | ESR1KDM4ECA1CA2CA4 | |
| SCHEMBL6553033 | 0.83 | TDP1 (0.41) | ESR1KDM4ECA1CA2CA4 | |
| SCHEMBL27983290 | 0.83 | ALOX5 (0.47) | ALOX5PTPN1HTR1ATRPV1 | |
| SCHEMBL18035640 | 0.83 | ALOX5 (0.44) | CA1CA2ALOX5HPGDTRPV1 | |
| SCHEMBL28238937 | 0.83 | CA1 (0.45) | ESR1KDM4ECA1CA2CA4 | |
| SCHEMBL5606507 | 0.83 | PPARG (0.48) | ESR1KDM4ECA1CA2CA4 | |
| SCHEMBL17459717 | 0.82 | ESR1 (0.49) | ESR1CA1CA2CA12CA7 |
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-2230312-A1 | Probe compound for detecting and isolating enzymes and means and methods using the same | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2010-09-22 | — | — | EP | disclosed |