Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 8/20 | 0.43 |
| ▸ | TSPO | P30536 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HRH2 | P25021 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL4491009 | 0.83 | ALDH1A1 (0.43) | ALDH1A1RAB9AKDM4EPOLBMAPT | |
| SCHEMBL4490745 | 0.82 | GRIA2 (0.40) | ALDH1A1KDM4EMAPK1 | |
| SCHEMBL4504902 | 0.82 | AR (0.57) | ARALDH1A1KDM4EPOLBMAPT | |
| SCHEMBL4498679 | 0.80 | CCNC (0.36) | ALDH1A1RAB9AKDM4EPOLBMAPT | |
| SCHEMBL4495477 | 0.78 | ALDH1A1 (0.42) | ARTDP1ALDH1A1RAB9AKDM4E | |
| SCHEMBL4477472 | 0.71 | PGR (0.48) | ARALDH1A1KDM4EMAPT | |
| SCHEMBL4480912 | 0.68 | — | — | |
| SCHEMBL4496740 | 0.68 | GRM5 (0.39) | RAB9AKDM4EPOLBMAPT | |
| SCHEMBL4500631 | 0.68 | DHODH (0.37) | ARALDH1A1PKMKDM4E | |
| SCHEMBL4504195 | 0.68 | CCR1 (0.38) | ALDH1A1RAB9APKMKDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7504429-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2009-03-17 | — | — | US | claimed |