Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 9/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | BDKRB1 | P46663 | 2/20 | 0.33 |
| ▸ | FAAH | O00519 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL185881 | 0.92 | OPRL1 (0.37) | CNR2TRPV1BDKRB1FAAH | |
| SCHEMBL185940 | 0.91 | CNR2 (0.34) | CNR2TRPV1TP53FAAHCYP1A2 | |
| SCHEMBL187048 | 0.91 | CNR2 (0.37) | CNR2TRPV1TP53BDKRB1FAAH | |
| SCHEMBL2805619 | 0.90 | BDKRB1 (0.40) | CNR2TP53BDKRB1CYP1A2CYP2D6 | |
| SCHEMBL186586 | 0.90 | CNR2 (0.36) | CNR2TRPV1BDKRB1POLB | |
| SCHEMBL186119 | 0.90 | PTK2 (0.37) | CNR2TRPV1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL186188 | 0.89 | CNR2 (0.35) | CNR2TRPV1TP53FAAHCYP1A2 | |
| SCHEMBL185942 | 0.89 | FAAH (0.38) | TRPV1BDKRB1FAAHPOLB | |
| SCHEMBL186992 | 0.89 | CNR2 (0.33) | CNR2TRPV1TP53BDKRB1FAAH | |
| SCHEMBL186210 | 0.88 | POLB (0.34) | CNR2TP53MDM2CYP1A2CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2401256-A1 | COMPOUNDS AS BRADYKININ B1 ANTAGONISTS | Boehringer Ingelheim International GmbH (DE) | 2012-01-04 | — | — | EP | disclosed |
| WO-2010097372-A1 | COMPOUNDS AS BRADYKININ B1 ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-09-02 | — | — | WO | disclosed |