Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | APLNR | P35414 | 1/20 | 0.36 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL323830 | 0.77 | SLC6A2 (0.41) | ALDH1A1L3MBTL1NPC1SLC6A2RECQL | |
| SCHEMBL6302948 | 0.76 | RAB9A (0.55) | ALDH1A1KDM4EL3MBTL1RAB9AMAPT | |
| SCHEMBL14377256 | 0.75 | LTA4H (0.50) | TDP1 | |
| SCHEMBL14377000 | 0.75 | SCN1A (0.39) | ALDH1A1KDM4ETDP1CYP3A4 | |
| SCHEMBL12289108 | 0.75 | HCRTR2 (0.37) | ALDH1A1KDM4EL3MBTL1RAB9AMAPT | |
| SCHEMBL13843050 | 0.74 | POLB (0.39) | ALDH1A1KDM4EL3MBTL1RAB9AMAPT | |
| SCHEMBL14376682 | 0.74 | ALDH1A1 (0.46) | ALDH1A1KDM4E | |
| SCHEMBL323831 | 0.74 | ALDH1A1 (0.48) | ALDH1A1KDM4EL3MBTL1RAB9AMAPT | |
| SCHEMBL13063918 | 0.73 | SLC6A2 (0.41) | ALDH1A1L3MBTL1SLC6A2RECQLALOX5AP | |
| SCHEMBL20224823 | 0.73 | SLC6A2 (0.44) | ALDH1A1KDM4ERAB9AMAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011104340-A1 | THIENOPYRIMIDINES CONTAINING A SUBSTITUTED ALKYL GROUP FOR PHARMACEUTICAL COMPOSITIONS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-09-01 | — | — | WO | disclosed |