Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNMT1 | P26358 | 5/20 | 0.54 |
| ▸ | DNMT3A | Q9Y6K1 | 4/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.54 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.54 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.48 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.48 |
| ▸ | GAK | O14976 | 1/20 | 0.48 |
| ▸ | MLYCD | O95822 | 1/20 | 0.48 |
| ▸ | CCNC | P24863 | 1/20 | 0.47 |
| ▸ | CDK8 | P49336 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28845664 | 0.86 | NSD2 (0.49) | AURKAAURKBGAKCCNCCDK8 | |
| SCHEMBL29810070 | 0.86 | NSD2 (0.49) | AURKAAURKBGAKCCNCCDK8 | |
| SCHEMBL28845677 | 0.85 | GAK (0.54) | DNMT1DNMT3AHDAC1HDAC6HDAC3 | |
| SCHEMBL28845680 | 0.85 | GAK (0.51) | DNMT1DNMT3AHDAC1HDAC6HDAC3 | |
| SCHEMBL10664310 | 0.84 | GAK (0.57) | DNMT1DNMT3AHDAC1HDAC6HDAC3 | |
| SCHEMBL28845671 | 0.84 | GAK (0.53) | DNMT1DNMT3AHDAC1HDAC6HDAC3 | |
| Hydrochloric Acid SCHEMBL11523664 | 0.83 | GAK (0.56) | DNMT1DNMT3AHDAC1HDAC6HDAC3 | |
| SCHEMBL28845632 | 0.83 | GAK (0.49) | DNMT1DNMT3AHDAC1HDAC6HDAC3 | |
| SCHEMBL28845665 | 0.82 | CCNC (0.51) | DNMT1DNMT3AHDAC1HDAC6HDAC3 | |
| SCHEMBL29200458 | 0.81 | GAK (0.64) | MAPTAURKBGAKCCNCCDK8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114773267-A | [ (7-trifluoromethyl quinoline-4-yl) amino ] benzamide compound and preparation and application thereof | 沈阳药科大学 | 2022-07-22 | — | — | CN | claimed |
| CN-114773267-B | [ (7-trifluoromethyl quinoline-4-yl) amino ] benzamide compound and preparation and application thereof | 沈阳药科大学 | 2024-01-26 | — | — | CN | disclosed |
| CN-114773267-A | [ (7-trifluoromethyl quinoline-4-yl) amino ] benzamide compound and preparation and application thereof | 沈阳药科大学 | 2022-07-22 | — | — | CN | disclosed |