Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | DHODH | Q02127 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL14469812 | 0.83 | KMT2A (0.38) | GPBAR1KMT2AMEN1DHODHSLC6A2 | |
| SCHEMBL14469705 | 0.81 | TDP1 (0.42) | ALDH1A1CYP3A4L3MBTL1MAPTNPC1 | |
| SCHEMBL14469714 | 0.80 | TSHR (0.45) | ALDH1A1NPSR1CYP3A4GPBAR1KMT2A | |
| SCHEMBL14469683 | 0.80 | GPBAR1 (0.40) | GPBAR1KMT2AMEN1SLC6A2SLC6A3 | |
| SCHEMBL3596032 | 0.69 | RXRA (0.43) | ALDH1A1CYP2C9CYP2C19CYP3A4CYP1A2 | |
| SCHEMBL3596034 | 0.69 | RXRA (0.43) | ALDH1A1CYP2C9CYP2C19CYP3A4CYP1A2 | |
| SCHEMBL2705832 | 0.68 | KMT2A (0.76) | ALDH1A1NPSR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL10611772 | 0.66 | KMT2A (0.73) | ALDH1A1NPSR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL6836717 | 0.64 | MAPT (0.56) | ALDH1A1NPSR1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL29193169 | 0.63 | LMNA (0.81) | ALDH1A1NPSR1CYP2C9CYP2C19CYP3A4 |
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-1686983-B1 | USE OF PENTADIENOIC ACID DERIVATES FOR TREATEMENT OF HYPERURICEMIA | MERCK PATENT GMBH (DE) | 2007-07-11 | — | — | EP | disclosed |