Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.34 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.34 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | TDO2 | P48775 | 2/20 | 0.34 |
| ▸ | VCAM1 | P19320 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL994700 | 1.00 | TDP1 (0.36) | TDP1ATMPIN1ALDH1A1HIF1A | |
| SCHEMBL16486293 | 0.92 | KDM4E (0.36) | TDP1ATMPIN1ALDH1A1HIF1A | |
| SCHEMBL4712057 | 0.85 | EGFR (0.39) | TDP1ALDH1A1TSHRMAPTPKM | |
| SCHEMBL16470135 | 0.83 | MAPT (0.41) | TDP1ATMALDH1A1HIF1AHPGD | |
| SCHEMBL29969235 | 0.83 | CYP1A2 (0.37) | TDP1PIN1ALDH1A1TSHRMAPT | |
| SCHEMBL26131871 | 0.83 | CYP1A2 (0.37) | TDP1PIN1ALDH1A1TSHRMAPT | |
| SCHEMBL21050767 | 0.82 | MAPT (0.37) | TDP1ALDH1A1HIF1ACYP3A4HPGD | |
| SCHEMBL24771867 | 0.81 | PIN1 (0.36) | TDP1PIN1ALDH1A1HIF1ACYP3A4 | |
| SCHEMBL18114309 | 0.80 | PDGFRB (0.43) | PIN1ALDH1A1MAPTEGFRHTT | |
| SCHEMBL25233608 | 0.77 | PDGFRB (0.43) | PIN1ALDH1A1MAPTEGFRHTT |
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-1902200-A | 1h-imidazoquinoline derivatives as protein kinase inhibitors | NOVARTIS AG (CH) | 2007-01-24 | — | — | CN | disclosed |