Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 3/20 | 0.71 |
| ▸ | WDR5 | P61964 | 1/20 | 0.47 |
| ▸ | IKBKB | O14920 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TOP1 | P11387 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TOP2A | P11388 | 1/20 | 0.43 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.43 |
| ▸ | F10 | P00742 | 1/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MASP2 | O00187 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3505979 | 0.92 | NQO2 (0.81) | NQO2WDR5ALDH1A1TOP1HPGD | |
| SCHEMBL5307850 | 0.90 | NQO2 (0.85) | NQO2WDR5ALDH1A1TOP1HPGD | |
| SCHEMBL23566322 | 0.87 | NQO2 (0.59) | NQO2ALDH1A1TOP1HPGDCASP1 | |
| SCHEMBL23566269 | 0.84 | PLAU (0.50) | NQO2IKBKBALDH1A1HPGDCASP1 | |
| SCHEMBL11113150 | 0.81 | APP (0.61) | NQO2IKBKBALDH1A1APPMASP2 | |
| SCHEMBL31237738 | 0.80 | APP (0.65) | NQO2IKBKBALDH1A1HPGDAPP | |
| Hydrochloric Acid SCHEMBL11108769 | 0.78 | APP (0.57) | NQO2IKBKBALDH1A1APPMASP2 | |
| SCHEMBL23566321 | 0.77 | NQO2 (0.67) | NQO2ALDH1A1TOP1HPGDCASP1 | |
| SCHEMBL14433307 | 0.76 | NQO2 (0.63) | NQO2WDR5ALDH1A1TOP1HPGD | |
| SCHEMBL23566323 | 0.76 | NQO2 (0.58) | NQO2ALDH1A1TOP1HPGDCASP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021127452-A1 | COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS AND POTENTIATION OF ANTIBIOTICS | GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) | 2021-06-24 | — | — | WO | disclosed |