Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.43 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SI | P14410 | 1/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13457064 | 0.86 | ALDH1A1 (0.52) | ALDH1A1SOAT1KDM4EKMT2AALOX15 | |
| SCHEMBL29172881 | 0.84 | KDM4E (0.38) | OPRM1KDM4EKMT2A | |
| SCHEMBL8311343 | 0.83 | ALDH1A1 (0.44) | ALDH1A1OPRM1SOAT1KDM4EKMT2A | |
| SCHEMBL6898926 | 0.82 | ALDH1A1 (0.48) | ALDH1A1SOAT1KDM4EKMT2AALOX15 | |
| SCHEMBL14959847 | 0.82 | ALDH1A1 (0.48) | ALDH1A1SOAT1KDM4EKMT2AALOX15 | |
| SCHEMBL10087948 | 0.81 | ALDH1A1 (0.46) | ALDH1A1SOAT1KDM4EKMT2AALOX15 | |
| SCHEMBL12789453 | 0.75 | TSHR (0.47) | ALDH1A1KDM4EKMT2AMEN1MAPT | |
| SCHEMBL23425700 | 0.75 | MAPT (0.38) | ALDH1A1OPRM1KMT2AMEN1MAPT | |
| SCHEMBL28840051 | 0.74 | KDM4E (0.32) | KDM4EKMT2A | |
| SCHEMBL26919582 | 0.74 | KDM4E (0.36) | OPRM1KDM4EKMT2A |
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 |