Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.68 |
| ▸ | DCTPP1 | Q9H773 | 3/20 | 0.62 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | PPARG | P37231 | 3/20 | 0.52 |
| ▸ | KIF11 | P52732 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | BRD4 | O60885 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | RORC | P51449 | 1/20 | 0.50 |
| ▸ | DHFR | P00374 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8025911 | 0.89 | KDM4E (0.70) | KDM4EDCTPP1NPC1HDAC1HDAC6 | |
| SCHEMBL2161533 | 0.88 | KDM4E (0.68) | KDM4EDCTPP1MAPTGAANPC1 | |
| SCHEMBL29343401 | 0.88 | KDM4E (0.61) | KDM4EDCTPP1MAPTGAANPC1 | |
| SCHEMBL29342743 | 0.88 | KDM4E (0.64) | KDM4EDCTPP1MAPTPPARGKIF11 | |
| SCHEMBL4532827 | 0.86 | PPARG (0.68) | KDM4EDCTPP1MAPTHDAC1HDAC6 | |
| SCHEMBL12004096 | 0.85 | KDM4E (0.52) | KDM4EDCTPP1MAPTNPC1NLRP3 | |
| SCHEMBL8036225 | 0.83 | PPARG (0.65) | KDM4EMAPTHDAC1HDAC6PPARG | |
| SCHEMBL6172139 | 0.82 | DCTPP1 (0.60) | KDM4EDCTPP1MAPTGAANPC1 | |
| SCHEMBL1731129 | 0.81 | KDM4E (1.00) | KDM4EMAPTGAANPC1TDP1 | |
| SCHEMBL17195873 | 0.81 | CFTR (0.59) | KDM4EMAPTPPARGKIF11 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018053161-A1 | NOVEL SUBSTITUTED BENZIMIDAZOLE DERIVATIVES AS D-AMINO ACID OXIDASE (DAAO) INHIBITORS | NATIONAL TAIWAN UNIVERSITY (TW) | 2018-03-22 | — | — | WO | disclosed |