Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.31 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.31 |
| ▸ | F7 | P08709 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.30 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21556973 | 0.79 | EPHX2 (0.41) | KMT2ACA1CA2ALDH1A1 | |
| SCHEMBL17198871 | 0.74 | KMT2A (0.43) | KMT2AKDM4EALDH1A1TDP1 | |
| SCHEMBL19361244 | 0.74 | ALDH1A1 (0.46) | KMT2ACA1CA2CA7KDM4E | |
| SCHEMBL30496711 | 0.74 | KMT2A (0.43) | KMT2AKDM4EALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL28128871 | 0.73 | KMT2A (0.42) | KMT2AKDM4EALDH1A1TDP1 | |
| SCHEMBL19361243 | 0.72 | KLKB1 (0.38) | PTPN1KMT2AERCC1ERCC4CA1 | |
| SCHEMBL17198864 | 0.71 | CYP2C9 (0.39) | CA1CA2PTPN7DUSP3KDM4E | |
| SCHEMBL20852573 | 0.70 | NR1H4 (0.38) | KMT2AALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL30496742 | 0.70 | CYP2C9 (0.38) | CA1CA2PTPN7DUSP3KDM4E | |
| Hydrochloric Acid SCHEMBL28493837 | 0.70 | CYP2C9 (0.38) | CA1CA2PTPN7DUSP3KDM4E |
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-3567029-A1 | COMPOSITIONS, METHODS, AND SYSTEMS FOR THE SYNTHESIS AND USE OF IMAGING AGENTS | Lantheus Medical Imaging, Inc. (US) | 2019-11-13 | — | — | EP | disclosed |