Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | MEN1 | O00255 | 4/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.66 |
| ▸ | HCAR2 | Q8TDS4 | 5/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | DDO | Q99489 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | GFER | P55789 | 2/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3938222 | 0.81 | ATM (0.56) | ALDH1A1MEN1KMT2AKDM4EPOLB | |
| SCHEMBL30811844 | 0.79 | ALDH1A1 (1.00) | ALDH1A1MEN1KMT2AKDM4EHCAR2 | |
| SCHEMBL23620799 | 0.79 | ALDH1A1 (0.57) | ALDH1A1MEN1KMT2AKDM4EHCAR2 | |
| SCHEMBL686621 | 0.79 | HCAR3 (0.44) | ALDH1A1MEN1KMT2AKDM4EPOLB | |
| Butane SCHEMBL11036256 | 0.77 | CYP2C9 (0.67) | ALDH1A1MEN1KMT2AKDM4EHCAR2 | |
| SCHEMBL846393 | 0.76 | CYP2C9 (0.61) | ALDH1A1MEN1KMT2AKDM4EHCAR2 | |
| SCHEMBL30281282 | 0.76 | CYP2C9 (0.61) | ALDH1A1MEN1KMT2AKDM4EHCAR2 | |
| SCHEMBL17820066 | 0.75 | ALDH1A1 (0.71) | ALDH1A1MEN1KMT2AKDM4EHCAR2 | |
| SCHEMBL51830 | 0.73 | HCAR2 (0.70) | ALDH1A1MEN1KMT2AKDM4EHCAR2 | |
| SCHEMBL13969513 | 0.73 | CHRNB2 (0.38) | ALDH1A1MEN1KMT2AMAPTMAPK1 |
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-1831198-B1 | PYRIDINE CARBOXAMIDE DERIVATIVES FOR USE AS ANTICANCER AGENTS | ASTRAZENECA AB (SE) | 2009-04-08 | — | — | EP | disclosed |