Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NAMPT | P43490 | 2/20 | 0.36 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2805090 | 0.85 | ALDH1A1 (0.43) | ALDH1A1MAPTHPGDHTTNPSR1 | |
| SCHEMBL185458 | 0.82 | ALDH1A1 (0.39) | ALDH1A1MAPTHPGDHTTNPSR1 | |
| SCHEMBL184945 | 0.80 | MT-CO2 (0.43) | ALDH1A1MAPTHPGDHTTNPSR1 | |
| SCHEMBL185024 | 0.80 | OPRL1 (0.36) | GAAPOLBRAB9AKMT2AAURKA | |
| SCHEMBL2805680 | 0.79 | ALDH1A1 (0.40) | ALDH1A1MAPTHPGDHTTNPSR1 | |
| SCHEMBL186501 | 0.79 | ALDH1A1 (0.40) | ALDH1A1MAPTHPGDHTTNPSR1 | |
| SCHEMBL186385 | 0.79 | CYP1A2 (0.38) | MAPTGAAPOLBRAB9AKDM4E | |
| SCHEMBL185956 | 0.78 | SIRT2 (0.36) | ALDH1A1GAARAB9AKMT2ALMNA | |
| SCHEMBL2781755 | 0.76 | POLB (0.40) | ALDH1A1MAPTHPGDHTTNPSR1 | |
| SCHEMBL185629 | 0.76 | POLB (0.36) | ALDH1A1HPGDGAAPOLBNPC1 |
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 |