Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB1 | P46663 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 9/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.34 |
| ▸ | HPGDS | O60760 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2808699 | 0.92 | BTK (0.34) | BDKRB1EPHX2BTKHPGDSPOLB | |
| SCHEMBL13165608 | 0.90 | BDKRB1 (0.37) | BDKRB1CCR5 | |
| SCHEMBL2788500 | 0.88 | BDKRB1 (0.43) | BDKRB1EPHX2HPGDSPOLBP2RX7 | |
| SCHEMBL13165601 | 0.88 | BDKRB1 (0.44) | BDKRB1EPHX2HPGDSPOLBP2RX7 | |
| SCHEMBL2787971 | 0.88 | CCR5 (0.38) | EPHX2BTKPOLBNPSR1P2RX7 | |
| SCHEMBL13165998 | 0.88 | BDKRB1 (0.44) | BDKRB1EPHX2HPGDSPOLBP2RX7 | |
| SCHEMBL13166000 | 0.87 | BDKRB1 (0.44) | BDKRB1EPHX2HPGDSPOLBP2RX7 | |
| SCHEMBL13166432 | 0.86 | BDKRB1 (0.44) | BDKRB1EPHX2HPGDSPOLBPPARG | |
| SCHEMBL764412 | 0.86 | BDKRB1 (0.53) | BDKRB1EPHX2HPGDSPOLBP2RX7 | |
| SCHEMBL13165603 | 0.86 | BDKRB1 (0.45) | BDKRB1EPHX2HPGDSPOLBPPARG |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010097374-A1 | COMPOUNDS FOR USE AS BRADYKININ B1 ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-09-02 | — | — | WO | disclosed |