Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | NPBWR1 | P48145 | 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 | |
|---|---|---|---|---|
| SCHEMBL17436168 | 0.77 | HDAC6 (0.43) | KDM4EALDH1A1IDO1ARMAOB | |
| SCHEMBL5380250 | 0.76 | KDM4E (0.56) | LTA4HKDM4EALDH1A1ATMIDO1 | |
| SCHEMBL1861221 | 0.75 | KDM4E (0.44) | LTA4HKDM4EALDH1A1ATMIDO1 | |
| SCHEMBL1748339 | 0.73 | IDO1 (0.42) | LTA4HKDM4EALDH1A1ATMIDO1 | |
| SCHEMBL15637377 | 0.73 | IDO1 (0.48) | LTA4HKDM4EALDH1A1ATMIDO1 | |
| SCHEMBL28174656 | 0.72 | IDO1 (0.47) | LTA4HKDM4EALDH1A1ATMIDO1 | |
| SCHEMBL13316625 | 0.71 | MPO (0.41) | P2RX7 | |
| SCHEMBL15637274 | 0.71 | AR (0.46) | LTA4HKDM4EALDH1A1ATMIDO1 | |
| SCHEMBL30097936 | 0.70 | TRPA1 (0.45) | ALDH1A1ARTDP1 | |
| SCHEMBL14871016 | 0.70 | KDM4E (0.52) | LTA4HKDM4EALDH1A1ATMIDO1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101479257-A | Pyrimidine and quinazoline derivatives | HOFFMANN LA ROCHE (CH) | 2009-07-08 | — | — | CN | disclosed |