Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | IGF1R | P08069 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8720045 | 0.82 | ALDH1A1 (0.34) | POLBIGF1RALDH1A1KMT2A | |
| SCHEMBL6088742 | 0.81 | KDM4E (0.46) | KDM4EPOLBCHEK1ALDH1A1KMT2A | |
| SCHEMBL15380984 | 0.78 | ALDH1A1 (0.36) | POLBIGF1RALDH1A1KMT2A | |
| SCHEMBL8686614 | 0.77 | KDM4E (0.38) | KDM4EPOLBALDH1A1 | |
| SCHEMBL6090420 | 0.77 | CHEK1 (0.43) | KDM4EPOLBCHEK1ALDH1A1KMT2A | |
| SCHEMBL4107546 | 0.75 | P2RX7 (0.34) | KDM4EPOLBIGF1RALDH1A1KMT2A | |
| SCHEMBL5358334 | 0.74 | ALDH1A1 (0.39) | KDM4EPOLBCHEK1IGF1RALDH1A1 | |
| SCHEMBL6090987 | 0.73 | CHEK1 (0.51) | KDM4EPOLBCHEK1ALDH1A1KMT2A | |
| SCHEMBL8717359 | 0.69 | P2RX7 (0.30) | — | |
| SCHEMBL18825085 | 0.68 | HIF1A (0.41) | KDM4ECHEK1ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5733903-A | ANTITUMOR AGENTS WITH DIAMAGNETISM | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 1998-03-31 | — | — | US | disclosed |