Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
| ▸ | NQO2 | P16083 | 1/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL28041606 | 0.89 | KDM4E (0.47) | KDM4EALDH1A1MAPTLMNAL3MBTL1 | |
| SCHEMBL29660570 | 0.84 | KDM4E (0.57) | KDM4EALDH1A1MAPTLMNAL3MBTL1 | |
| SCHEMBL4596211 | 0.84 | KDM4E (0.57) | KDM4EALDH1A1MAPTLMNAL3MBTL1 | |
| SCHEMBL28041579 | 0.80 | DHODH (0.49) | KDM4EALDH1A1MAPTL3MBTL1MEN1 | |
| SCHEMBL28823862 | 0.80 | FABP4 (0.54) | KDM4EALDH1A1MAPTLMNARAB9A | |
| SCHEMBL28361368 | 0.79 | ESR1 (0.64) | KDM4EALDH1A1MAPTLMNAL3MBTL1 | |
| SCHEMBL28197192 | 0.79 | KDM4E (0.60) | KDM4EALDH1A1MAPTLMNAL3MBTL1 | |
| SCHEMBL28041598 | 0.78 | KDM4E (0.56) | KDM4EALDH1A1MAPTLMNAL3MBTL1 | |
| SCHEMBL861205 | 0.77 | CYP1A1 (0.50) | KDM4EALDH1A1MAPTLMNAL3MBTL1 | |
| SCHEMBL27956647 | 0.77 | ESR1 (0.70) | KDM4EALDH1A1MAPTLMNAL3MBTL1 |
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 |