Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP6 | P55212 | 4/20 | 0.71 |
| ▸ | NSD2 | O96028 | 3/20 | 0.71 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.71 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.71 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.71 |
| ▸ | NT5E | P21589 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.44 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.42 |
| ▸ | SUMO2 | P61956 | 3/20 | 0.42 |
| ▸ | SUMO1 | P63165 | 3/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.42 |
| ▸ | SENP2 | Q9HC62 | 3/20 | 0.42 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL156430 | 1.00 | CASP6 (0.71) | CASP6NSD2DUSP3PTPN5PTPN11 | |
| SCHEMBL27457776 | 0.98 | CASP6 (0.69) | CASP6NSD2DUSP3PTPN5PTPN11 | |
| SCHEMBL1367724 | 0.98 | CASP6 (0.69) | CASP6NSD2DUSP3PTPN5PTPN11 | |
| Water SCHEMBL138858 | 0.97 | CASP6 (0.67) | CASP6NSD2DUSP3PTPN5PTPN11 | |
| Terephthalic Acid SCHEMBL10934299 | 0.90 | CASP6 (0.58) | CASP6NSD2DUSP3PTPN5PTPN11 | |
| SCHEMBL151762 | 0.88 | NT5E (0.73) | CASP6NSD2DUSP3PTPN5PTPN11 | |
| SCHEMBL8968523 | 0.88 | NT5E (0.73) | CASP6NSD2DUSP3PTPN5PTPN11 | |
| SCHEMBL8713026 | 0.88 | NT5E (0.73) | CASP6NSD2DUSP3PTPN5PTPN11 | |
| SCHEMBL29392802 | 0.88 | NT5E (0.73) | CASP6NSD2DUSP3PTPN5PTPN11 | |
| SCHEMBL29215781 | 0.87 | CASP6 (0.57) | CASP6NSD2DUSP3PTPN5PTPN11 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3609892-A1 | IMPROVED SYNTHESIS OF NIR FLUORESCENT PROBE | Bracco Imaging SpA (IT) | 2020-02-19 | — | — | EP | disclosed |
| WO-2018189136-A1 | IMPROVED SYNTHESIS OF NIR FLUORESCENT PROBE | BRACCO IMAGING SPA (IT) | 2018-10-18 | — | — | WO | disclosed |
| WO-2002024816-A1 | ROTAXANE DYES | BASF AKTIENGESELLSCHAFT (DE) | 2002-03-28 | — | — | WO | disclosed |