Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB2 | P30411 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.35 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| SCHEMBL1177962 | 0.89 | BDKRB2 (0.41) | BDKRB2TP53CYP1A2CYP3A4CYP2D6 | |
| Bicarbonate SCHEMBL3696603 | 0.88 | BDKRB2 (0.43) | BDKRB2DRD2DRD4DRD3TP53 | |
| SCHEMBL1177999 | 0.86 | BDKRB2 (0.40) | BDKRB2CNR2DRD2 | |
| SCHEMBL7606058 | 0.81 | ALOX5 (0.39) | DRD2DRD4DRD3AGTR1AGTR2 | |
| SCHEMBL1063123 | 0.79 | LMNA (0.49) | TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3691681 | 0.79 | BDKRB2 (0.38) | BDKRB2CNR1CNR2PTGESTP53 | |
| SCHEMBL3694072 | 0.78 | BDKRB2 (0.37) | BDKRB2PTGESTP53CYP1A2CYP3A4 | |
| SCHEMBL12871494 | 0.77 | FAAH (0.37) | FAAHCNR1CNR2DRD2DRD4 | |
| SCHEMBL3690690 | 0.75 | BDKRB2 (0.38) | BDKRB2TP53CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3704972 | 0.75 | BDKRB2 (0.38) | BDKRB2TP53CYP1A2CYP3A4CYP2D6 |
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 |