Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | MAPT | P10636 | 6/20 | 0.45 |
| ▸ | PKM | P14618 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27699296 | 0.82 | ALDH1A1 (0.50) | ALDH1A1MAPTPKMHTTKDM4E | |
| SCHEMBL27645641 | 0.82 | ALDH1A1 (0.54) | ALDH1A1MAPTPKMHTTKDM4E | |
| SCHEMBL28279678 | 0.81 | MEN1 (0.46) | ALDH1A1MAPTPKMHTTKDM4E | |
| SCHEMBL27645537 | 0.79 | ALDH1A1 (0.47) | ALDH1A1MAPTPKMHTTKDM4E | |
| SCHEMBL11310071 | 0.73 | MAPT (0.52) | ALDH1A1MAPTPKMHTTKDM4E | |
| SCHEMBL6672586 | 0.72 | ALDH1A1 (0.57) | ALDH1A1MAPTPKMHTTKDM4E | |
| SCHEMBL28247028 | 0.70 | MAPK1 (0.41) | ALDH1A1PKMHTTKDM4EMAPK1 | |
| SCHEMBL28147295 | 0.68 | ALDH1A1 (0.78) | ALDH1A1MAPTPKMHTTKDM4E | |
| SCHEMBL27483362 | 0.67 | ATM (0.52) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL9763031 | 0.67 | ALDH1A1 (0.49) | ALDH1A1MAPTPKMHTTKDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106565584-B | A kind of preparation method of 3,4- bis- (4- bromophenyl) -1H- pyrrole-2,5-diones | 东华大学 | 2019-03-08 | — | — | CN | disclosed |
| CN-106565584-A | Preparing method for 3,4-bis(4-bromophenyl)-1H-pyrrole-2,5-diketone | 东华大学 | 2017-04-19 | — | — | CN | disclosed |
| CN-106565584-A | Preparing method for 3,4-bis(4-bromophenyl)-1H-pyrrole-2,5-diketone | 东华大学 | 2017-04-19 | — | — | CN | disclosed |
| CN-103804108-B | A kind of method preparing primary amine | 沈阳药科大学 | 2016-08-03 | — | — | CN | disclosed |