Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.32 |
| ▸ | SLC37A4 | O43826 | 1/20 | 0.30 |
| ▸ | ERN1 | O75460 | 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 | |
|---|---|---|---|---|
| SCHEMBL9520799 | 1.00 | NQO1 (0.39) | NQO1ALOX5SLC37A4ERN1 | |
| SCHEMBL9520715 | 0.84 | KDM4E (0.33) | — | |
| SCHEMBL9521041 | 0.84 | KDM4E (0.33) | — | |
| SCHEMBL9521194 | 0.84 | AKT1 (0.35) | — | |
| SCHEMBL9755794 | 0.80 | NQO1 (0.42) | NQO1ALOX5SLC37A4 | |
| SCHEMBL8903328 | 0.78 | NQO1 (0.40) | NQO1ALOX5SLC37A4 | |
| SCHEMBL8903047 | 0.78 | NQO1 (0.40) | NQO1ALOX5SLC37A4 | |
| SCHEMBL8901762 | 0.78 | NQO1 (0.38) | NQO1ALOX5 | |
| SCHEMBL8901552 | 0.78 | NQO1 (0.38) | NQO1ALOX5 | |
| SCHEMBL9755781 | 0.76 | HTT (0.34) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0533744-A1 | HETEROCYCLIC ANTHRACYCLIONE AND ANTHRACYCLINE ANALOGS | BIOCHEM PHARMA INC. (CA) | 1993-03-31 | — | — | EP | claimed |
| WO-1991019725-A2 | HETEROCYCLIC ANTHRACYCLIONE AND ANTHRACYCLINE ANALOGS | BIOCHEM PHARMA INC. (CA) | 1991-12-26 | — | — | WO | claimed |
| EP-0540604-A1 | SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B 4? ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS | Aventis Pharma S.A. (FR) | 1993-05-12 | — | — | EP | disclosed |
| WO-1992001675-A2 | SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B4 ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS | RHONE-POULENC RORER S.A. (FR) | 1992-02-06 | — | — | WO | disclosed |