Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VNN1 | O95497 | 7/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 5/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | GLA | P06280 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 2/20 | 0.37 |
| ▸ | CASP7 | P55210 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL186223 | 0.86 | HCAR3 (0.43) | VNN1HCAR3ACACBALDH1A1HSD17B10 | |
| SCHEMBL16824294 | 0.80 | HCAR3 (0.48) | VNN1HCAR3ACACBMAPK1CYP1A2 | |
| SCHEMBL186008 | 0.79 | GRM5 (0.39) | VNN1HCAR3ACACBCYP1A2ALDH1A1 | |
| SCHEMBL10589105 | 0.76 | CYP1A2 (0.41) | MAPK1L3MBTL1CYP1A2ALDH1A1HSD17B10 | |
| SCHEMBL186657 | 0.76 | KMT2A (0.34) | CYP1A2ALDH1A1GLAHSD17B10MEN1 | |
| SCHEMBL186359 | 0.76 | HCAR3 (0.61) | VNN1HCAR3ACACBALDH1A1HSD17B10 | |
| SCHEMBL200701 | 0.75 | HDAC3 (0.41) | VNN1HCAR3ACACBPKMMAPK1 | |
| SCHEMBL186125 | 0.74 | KMT2A (0.40) | ACACBMAPK1L3MBTL1GLAKMT2A | |
| SCHEMBL19609085 | 0.73 | MAPK1 (0.49) | VNN1HCAR3ACACBPKMMAPK1 | |
| SCHEMBL185620 | 0.72 | LMNA (0.35) | ALDH1A1GLAHSD17B10MEN1KMT2A |
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 |