Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | APLNR | P35414 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | AGER | Q15109 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL238763 | 0.78 | SMN1; SMN2 (0.46) | TDP1MAPTDHODHKDM4EALDH1A1 | |
| SCHEMBL5582871 | 0.78 | KDM4E (0.36) | TDP1MAPTKDM4EALDH1A1CYP3A4 | |
| SCHEMBL118711 | 0.78 | MEN1 (0.46) | MAPTSLC22A12KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL8699109 | 0.76 | TDP1 (0.41) | SLC13A5TDP1MAPTGAADHODH | |
| SCHEMBL17467141 | 0.76 | POLB (0.37) | TDP1KDM4EALDH1A1L3MBTL1POLB | |
| SCHEMBL21598413 | 0.75 | TDP1 (0.40) | SLC13A5TDP1FFAR4MAPTGAA | |
| SCHEMBL5655590 | 0.74 | CA12 (0.43) | MAPTALDH1A1L3MBTL1POLB | |
| SCHEMBL6615497 | 0.74 | CHRM2 (0.36) | MAPTKDM4EALDH1A1CYP3A4ALOX15 | |
| SCHEMBL22589893 | 0.74 | ALDH1A1 (0.38) | MAPTKDM4EALDH1A1L3MBTL1POLB | |
| SCHEMBL16812908 | 0.73 | APLNR (0.43) | SLC13A5TDP1APLNRBTKNFE2L2 |
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-7960394-B2 | 3,8-dimethyl-2-[4-(3-piperidin-1-ylpropoxy)phenyl]-4(3H)-quinazolinone; 6-chloro-3-methyl-2-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrido[3,4-d]-pyrimidin-4(3H)-one; 2-[4-(1-cyclopentyl-4-piperidinyloxy)phenyl]-3-methylpyrido[2,3-d]-pyrimidin-4(3H)-one; treats metabolic, nervous system, vascular disorders | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2011-06-14 | — | — | US | disclosed |