Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | SLC6A5 | Q9Y345 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.31 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
| ▸ | HPGDS | O60760 | 1/20 | 0.31 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14856552 | 0.80 | HTR2A (0.33) | HTR2ASLC6A5LMNAP2RX3ALDH1A1 | |
| SCHEMBL2808309 | 0.72 | CYP4F2 (0.38) | HTTCYP4F2CYP4A11HPGDS | |
| SCHEMBL198340 | 0.65 | GPR132 (0.36) | LMNAALDH1A1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL10065476 | 0.64 | CYP4F2 (0.36) | HTR2ASLC6A5LMNAP2RX3ALDH1A1 | |
| SCHEMBL184727 | 0.63 | HDAC3 (0.39) | DGAT2 | |
| SCHEMBL10070601 | 0.63 | SPHK1 (0.37) | HTR2ASLC6A5LMNAP2RX3ALDH1A1 | |
| SCHEMBL2808139 | 0.62 | DDB1 (0.40) | CYP4F2CYP4A11 | |
| SCHEMBL185116 | 0.61 | LMNA (0.40) | LMNAALDH1A1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL14856657 | 0.61 | KDM4E (0.45) | ALDH1A1SMN1; SMN2CYP4F2CYP4A11XDH | |
| SCHEMBL185855 | 0.61 | KDM4E (0.41) | LMNAALDH1A1XDHDGAT2KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2401256-B1 | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT (DE) | 2013-04-17 | — | — | EP | disclosed |
| 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 |