Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.72 |
| ▸ | MEN1 | O00255 | 3/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.72 |
| ▸ | LMNA | P02545 | 2/20 | 0.72 |
| ▸ | POLB | P06746 | 2/20 | 0.72 |
| ▸ | HTT | P42858 | 2/20 | 0.72 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.72 |
| ▸ | HPGD | P15428 | 1/20 | 0.72 |
| ▸ | NPY1R | P25929 | 1/20 | 0.72 |
| ▸ | HDAC1 | Q13547 | 15/20 | 0.66 |
| ▸ | HDAC3 | O15379 | 10/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 10/20 | 0.64 |
| ▸ | HDAC6 | Q9UBN7 | 10/20 | 0.64 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | IDE | P14735 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL28064562 | 0.90 | KDM4E (0.73) | KDM4EALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL28064412 | 0.90 | KDM4E (0.88) | KDM4EALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL28064416 | 0.89 | KDM4E (0.72) | KDM4EALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL28064414 | 0.89 | ALDH1A1 (0.72) | KDM4EALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL28064530 | 0.81 | HDAC1 (0.72) | KDM4EALDH1A1MEN1KMT2AHTT | |
| SCHEMBL28064411 | 0.78 | HDAC1 (0.68) | KDM4EALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL28064532 | 0.77 | ALDH1A1 (0.54) | KDM4EALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL9960599 | 0.72 | MAPK1 (0.49) | KDM4EALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL28207162 | 0.71 | POLB (0.57) | KDM4EALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL17677958 | 0.70 | ALDH1A1 (0.52) | KDM4EALDH1A1MEN1KMT2ALMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105461723-B | Phthalazines simultaneously assimilation compound of [1,2, b] quinazoline 8 and preparation method thereof and the application in antineoplastic | 广西师范大学 | 2017-12-08 | — | — | CN | disclosed |
| CN-105461723-A | Phthalizine [1,2,b] quinazoline-8-ketone compound and preparation method and application in antitumor drugs of phthalizine [1,2,b] quinazoline-8-ketone compound | UNIV GUANGXI NORMAL | 2016-04-06 | — | — | CN | disclosed |