Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL184999 | 0.98 | ALDH1A1 (0.47) | ALDH1A1POLBSMN1; SMN2MAPTHDAC6 | |
| SCHEMBL29177386 | 0.85 | POLB (0.44) | ALDH1A1POLBSMN1; SMN2MAPTHDAC6 | |
| SCHEMBL16827279 | 0.83 | POLB (0.64) | ALDH1A1POLBHDAC6PTPN11MAPK1 | |
| SCHEMBL16827290 | 0.81 | ADRA1A (0.44) | ALDH1A1POLBSMN1; SMN2ACACBCYP2C9 | |
| SCHEMBL29224913 | 0.79 | ALDH1A1 (0.40) | ALDH1A1POLBSMN1; SMN2MAPTHDAC6 | |
| SCHEMBL16712258 | 0.79 | ALDH1A1 (0.48) | ALDH1A1POLBSMN1; SMN2MAPTLMNA | |
| SCHEMBL186135 | 0.77 | POLB (0.69) | ALDH1A1POLBSMN1; SMN2MAPTHDAC6 | |
| SCHEMBL16824368 | 0.74 | HDAC6 (0.46) | ALDH1A1SMN1; SMN2MAPTHDAC6ACACB | |
| SCHEMBL184998 | 0.74 | POLB (0.71) | ALDH1A1POLBSMN1; SMN2MAPTHDAC6 | |
| SCHEMBL29656709 | 0.74 | KMT2A (0.50) | ALDH1A1POLBSMN1; SMN2MAPTLMNA |
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 |