Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28823862 | 0.80 | FABP4 (0.54) | KDM4EHTTALDH1A1HPGDADORA2A | |
| SCHEMBL28041367 | 0.80 | KDM4E (0.50) | DHODHKDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL28041598 | 0.78 | KDM4E (0.56) | KDM4EHTTPOLBALDH1A1KMT2A | |
| SCHEMBL72673 | 0.77 | KDM4E (0.47) | DHODHKDM4EHTTPOLBMEN1 | |
| SCHEMBL28823807 | 0.76 | NPC1 (0.46) | DHODHKDM4EALDH1A1L3MBTL1CYP1A2 | |
| SCHEMBL789402 | 0.73 | CYP1A2 (0.41) | DHODHKDM4EHTTPOLBMEN1 | |
| SCHEMBL9971755 | 0.73 | ACHE (0.46) | DHODHKDM4EHTTPOLBMEN1 | |
| SCHEMBL840416 | 0.72 | CLK1 (0.51) | DHODHKDM4EHTTPOLBMEN1 | |
| SCHEMBL2720125 | 0.72 | RORC (0.53) | DHODHKDM4EHTTPOLBMEN1 | |
| SCHEMBL2717330 | 0.72 | DHODH (0.51) | DHODHKDM4EHTTPOLBMEN1 |
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-104086485-B | Prepare the method for poly-substituted quinoline type aromatic ring pyridine derivate | TSINGHUA UNIVERSITY (CN) | 2016-03-30 | — | — | CN | disclosed |