Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDGFRB | P09619 | 3/20 | 0.61 |
| ▸ | PDGFRA | P16234 | 3/20 | 0.61 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.51 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | MTOR | P42345 | 2/20 | 0.49 |
| ▸ | TOP1 | P11387 | 2/20 | 0.49 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.49 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.46 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2347880 | 0.92 | PDGFRB (0.66) | PDGFRBPDGFRACYP2A6NPC1RAB9A | |
| SCHEMBL29378174 | 0.92 | PDGFRB (0.66) | PDGFRBPDGFRACYP2A6NPC1RAB9A | |
| SCHEMBL26548412 | 0.87 | PDGFRB (0.60) | PDGFRBPDGFRACYP2A6NPC1RAB9A | |
| SCHEMBL26547991 | 0.87 | PDGFRB (0.60) | PDGFRBPDGFRACYP2A6NPC1RAB9A | |
| Quinoline SCHEMBL27808793 | 0.87 | CYP2A6 (0.70) | PDGFRBPDGFRACYP2A6NPC1RAB9A | |
| SCHEMBL26549071 | 0.86 | PDGFRB (0.58) | PDGFRBPDGFRACYP2A6NPC1RAB9A | |
| SCHEMBL26549364 | 0.86 | PDGFRB (0.58) | PDGFRBPDGFRACYP2A6NPC1RAB9A | |
| SCHEMBL26548915 | 0.86 | PDGFRB (0.58) | PDGFRBPDGFRACYP2A6NPC1RAB9A | |
| SCHEMBL26548595 | 0.86 | PDGFRB (0.58) | PDGFRBPDGFRACYP2A6NPC1RAB9A | |
| SCHEMBL30340895 | 0.85 | NPC1 (0.78) | NPC1RAB9APOLBALDH1A1PIK3CA |
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-102070520-A | Method for preparing 3-aryl-subsituted quinoline by 3-oxo-2,3-diarylpropionaldehyde | UNIV EAST CHINA NORMAL | 2011-05-25 | — | — | CN | disclosed |