Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DUT | P33316 | 3/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.33 |
| ▸ | TOP2A | P11388 | 2/20 | 0.33 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28699542 | 1.00 | DUT (0.36) | DUTNLRP3TOP2AFKBP1ANFKB1 | |
| SCHEMBL15320368 | 0.86 | ALDH1A1 (0.38) | DUTTOP2AFKBP1ANFKB1NFKB2 | |
| SCHEMBL15320366 | 0.86 | ALDH1A1 (0.38) | DUTTOP2AFKBP1ANFKB1NFKB2 | |
| SCHEMBL15957013 | 0.80 | DUT (0.36) | DUTTOP2AFKBP1A | |
| SCHEMBL3628010 | 0.80 | DUT (0.36) | DUTTOP2AFKBP1A | |
| SCHEMBL3739744 | 0.80 | DUT (0.36) | DUTTOP2AFKBP1A | |
| SCHEMBL28710557 | 0.79 | DUT (0.34) | DUTTOP2AFKBP1A | |
| SCHEMBL28710556 | 0.79 | DUT (0.34) | DUTTOP2AFKBP1A | |
| SCHEMBL19733026 | 0.78 | FKBP1A (0.32) | DUTTOP2AFKBP1A | |
| SCHEMBL19733021 | 0.76 | FKBP1A (0.32) | DUTTOP2AFKBP1A |
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-2834239-B1 | HETEROBICYCLIC COMPOUNDS AS BETA-LACTAMASE INHIBITORS | ENTASIS THERAPEUTICS LTD (GB) | 2017-12-27 | — | — | EP | disclosed |