Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | TTK | P33981 | 3/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | AURKA | O14965 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2806814 | 0.82 | LRRK2 (0.42) | TTKMCL1CYP1A2CYP2C19KMT2A | |
| SCHEMBL2807761 | 0.81 | NAMPT (0.51) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL2809520 | 0.79 | KDM4E (0.41) | KDM4ETSHRHSD17B10MT-CO2MCL1 | |
| SCHEMBL2810373 | 0.79 | CYP1A2 (0.41) | KDM4ETSHRHPGDHSD17B10MCL1 | |
| SCHEMBL6176833 | 0.78 | MAPK13 (0.59) | KDM4ETSHRHPGDHSD17B10MT-CO2 | |
| SCHEMBL4188631 | 0.77 | AURKA (0.59) | KDM4ETSHRHPGDHSD17B10GAA | |
| Trifluoroacetic Acid SCHEMBL185638 | 0.76 | TAS2R14 (0.46) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL2808918 | 0.76 | KMT2A (0.49) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL2806045 | 0.76 | ACACB (0.45) | KDM4EMAPK14SMN1; SMN2 | |
| SCHEMBL20552825 | 0.76 | HPGD (0.60) | KDM4ETSHRHPGDHSD17B10GAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102414177-B | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT | 2014-07-02 | — | — | CN | disclosed |
| 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 |