Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.44 |
| ▸ | TOP2A | P11388 | 4/20 | 0.35 |
| ▸ | TOP2B | Q02880 | 2/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8487417 | 0.90 | TOP2A (0.44) | NQO1TOP2ATOP2BPOLBKMT2A | |
| SCHEMBL10927511 | 0.87 | NQO1 (0.46) | NQO1TOP2ATOP2BEGFRMEN1 | |
| SCHEMBL8489718 | 0.87 | NQO1 (0.35) | NQO1POLBMAPTHTT | |
| SCHEMBL8487874 | 0.86 | NQO1 (0.35) | NQO1TOP2ATOP2BMAPTHTT | |
| SCHEMBL8485118 | 0.83 | CYP2D6 (0.36) | NQO1TOP2ATOP2BCYP1A2CYP3A4 | |
| SCHEMBL8483564 | 0.82 | TOP2A (0.41) | NQO1TOP2ATOP2B | |
| SCHEMBL10812237 | 0.81 | NQO1 (0.53) | NQO1TOP2ATOP2BEGFRMEN1 | |
| SCHEMBL8485482 | 0.81 | NQO1 (0.41) | NQO1TOP2ATOP2BEGFRMEN1 | |
| SCHEMBL8483509 | 0.79 | NQO1 (0.35) | NQO1TOP2ATOP2BMEN1POLB | |
| SCHEMBL8489284 | 0.78 | NQO1 (0.35) | NQO1TOP2ATOP2BMEN1POLB |
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-5935969-A | Pyrido-thiopyrandoinazoles with antitumor activity | UNIVERSITY OF VERMONT (US) | 1999-08-10 | — | — | US | disclosed |