Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.32 |
| ▸ | TPSD1 | Q9BZJ3 | 2/20 | 0.32 |
| ▸ | TPSG1 | Q9NRR2 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4604392 | 0.84 | SLC6A2 (0.33) | SLC6A2SLC6A4SLC6A3TPSAB1TPSD1 | |
| SCHEMBL4628886 | 0.83 | POLB (0.34) | POLBALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4720288 | 0.83 | POLB (0.34) | POLBALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1207252 | 0.77 | FKBP1A (0.42) | POLBALDH1A1KDM4EMAPK1 | |
| SCHEMBL4629748 | 0.75 | POLB (0.37) | POLBALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4718582 | 0.75 | TP53 (0.34) | POLBALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4719694 | 0.75 | POLB (0.37) | POLBALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5176485 | 0.73 | FKBP1A (0.47) | POLBALDH1A1KDM4EMAPK1 | |
| SCHEMBL1461712 | 0.72 | ALDH1A1 (0.44) | ALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL4717467 | 0.68 | ALDH1A1 (0.36) | ALDH1A1SLC6A2SLC6A4SLC6A3GAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1917256-A2 | SELECTED CGRP ANTAGONISTS, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS | Boehringer Ingelheim International GmbH (DE) | 2008-05-07 | — | — | EP | disclosed |
| WO-2007020261-A2 | SELECTED CGRP ANTAGONISTS, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-02-22 | — | — | WO | disclosed |