Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 9/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL765638 | 0.88 | EPHX2 (0.48) | EPHX2ALDH1A1SMN1; SMN2TSHRPOLB | |
| SCHEMBL755016 | 0.85 | EPHX2 (0.46) | EPHX2ALDH1A1SMN1; SMN2TSHRPOLB | |
| Cyclopropane SCHEMBL3650772 | 0.84 | EPHX2 (0.47) | EPHX2POLB | |
| SCHEMBL13165641 | 0.84 | EPHX2 (0.45) | EPHX2ALDH1A1SMN1; SMN2TSHRPOLB | |
| SCHEMBL13166053 | 0.83 | EPHX2 (0.44) | EPHX2ALDH1A1SMN1; SMN2TSHRPOLB | |
| SCHEMBL2549180 | 0.82 | L3MBTL1 (0.45) | EPHX2ALDH1A1SMN1; SMN2POLB | |
| SCHEMBL3642389 | 0.80 | L3MBTL1 (0.43) | EPHX2ALDH1A1SMN1; SMN2POLB | |
| SCHEMBL10121227 | 0.80 | EPHX2 (0.44) | EPHX2ALDH1A1 | |
| SCHEMBL15453396 | 0.79 | ALDH1A1 (0.81) | ALDH1A1SMN1; SMN2TSHRPOLBNPC1 | |
| SCHEMBL12238932 | 0.79 | L3MBTL1 (0.43) | EPHX2ALDH1A1SMN1; SMN2POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2188254-B1 | NOVEL BRADYKININ B1-ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2012-03-21 | — | — | EP | disclosed |