Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.51 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.51 |
| ▸ | PTGES | O14684 | 6/20 | 0.49 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.44 |
| ▸ | TUBB | P07437 | 1/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.44 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.44 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.44 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.44 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.44 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.44 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.44 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.44 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.44 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.44 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9958094 | 0.90 | PTGES (0.51) | ABCG2ABCB1ABCC1PTGESALOX5 | |
| SCHEMBL8442485 | 0.78 | POLH (0.64) | ABCG2EPHX2TUBB4ATUBBTUBA3C | |
| SCHEMBL17938761 | 0.77 | CYP3A4 (0.61) | ABCG2ABCB1EPHX2TUBB4ATUBB | |
| SCHEMBL3989919 | 0.77 | NOX4 (0.59) | ABCG2ABCB1ABCC1EPHX2ALOX5 | |
| SCHEMBL14263828 | 0.74 | CYP1B1 (0.59) | ABCC1EPHX2HDAC6PLG | |
| SCHEMBL23871902 | 0.72 | KDM4E (0.53) | ABCG2ABCB1ABCC1ACE2TUBB4A | |
| SCHEMBL10534553 | 0.72 | ABCG2 (0.84) | ABCG2ABCB1ABCC1EPHX2TUBB4A | |
| SCHEMBL3404530 | 0.72 | AKR1B1 (0.64) | ABCG2ABCB1ABCC1EPHX2TUBB4A | |
| SCHEMBL14254541 | 0.71 | CYP1B1 (0.55) | ABCC1EPHX2HDAC6PLG | |
| SCHEMBL3173862 | 0.71 | ABCG2 (0.62) | ABCG2ABCB1ABCC1TUBB4ATUBB |
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-2468741-A1 | Novel quercetin derivatives, their preparation, pharmaceutical compositions containing them and their use | Bel/Novamann International s.r.o. (SK) | 2012-06-27 | — | — | EP | disclosed |