Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB2 | P30411 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 6/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HTR1E | P28566 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3704972 | 1.00 | BDKRB2 (0.38) | BDKRB2PTGDR2TP53CYP1A2CYP3A4 | |
| SCHEMBL1178251 | 0.90 | BDKRB2 (0.42) | BDKRB2PTGDR2TP53CYP1A2CYP3A4 | |
| SCHEMBL1178809 | 0.90 | BDKRB2 (0.42) | BDKRB2PTGDR2TP53CYP1A2CYP3A4 | |
| Bicarbonate SCHEMBL3700166 | 0.89 | BDKRB2 (0.44) | BDKRB2PTGDR2TP53CYP1A2CYP3A4 | |
| Bicarbonate SCHEMBL3706241 | 0.89 | BDKRB2 (0.44) | BDKRB2PTGDR2TP53CYP1A2CYP3A4 | |
| SCHEMBL7602631 | 0.86 | MEN1 (0.42) | BDKRB2PTGDR2TP53CYP1A2CYP3A4 | |
| SCHEMBL1177736 | 0.86 | MEN1 (0.42) | BDKRB2PTGDR2TP53CYP1A2CYP3A4 | |
| SCHEMBL1177882 | 0.86 | MEN1 (0.42) | BDKRB2PTGDR2TP53CYP1A2CYP3A4 | |
| SCHEMBL7601926 | 0.84 | BDKRB2 (0.40) | BDKRB2PTGDR2TP53CYP1A2CYP3A4 | |
| SCHEMBL3695283 | 0.81 | PTGDR2 (0.45) | PTGDR2 |
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-2268625-B1 | OXO-HETEROCYCLIC SUBSTITUTED CARBOXYLIC ACID DERIVATES AND THE USE THEREOF | Bayer Pharma AG (DE) | 2012-05-16 | — | — | EP | disclosed |