Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Quinoline SCHEMBL28292999 | 0.87 | ALDH1A1 (0.49) | ALDH1A1HDAC1HDAC2HDAC3HDAC4 | |
| Quinoline SCHEMBL28140139 | 0.78 | ALDH1A1 (0.55) | ALDH1A1NPC1POLBRAB9AKDM4E | |
| Quinoline SCHEMBL28144363 | 0.78 | ALDH1A1 (0.55) | ALDH1A1HDAC8NPC1POLBRAB9A | |
| Quinoline SCHEMBL28213101 | 0.77 | ALDH1A1 (0.53) | ALDH1A1NPC1POLBRAB9AKDM4E | |
| Quinoline SCHEMBL5272119 | 0.77 | ALDH1A1 (0.74) | ALDH1A1PARP1HDAC1HDAC2NPC1 | |
| Quinoline SCHEMBL1287895 | 0.77 | ALDH1A1 (0.74) | ALDH1A1PARP1HDAC1HDAC2NPC1 | |
| Quinoline SCHEMBL2201840 | 0.77 | ALDH1A1 (0.74) | ALDH1A1PARP1HDAC1HDAC2NPC1 | |
| Quinoline SCHEMBL27782946 | 0.75 | ALDH1A1 (0.71) | ALDH1A1PARP1HDAC1HDAC2NPC1 | |
| Quinoline SCHEMBL28318728 | 0.75 | ALDH1A1 (0.55) | ALDH1A1NPC1POLBRAB9AKDM4E | |
| Quinoline SCHEMBL28087657 | 0.74 | ALDH1A1 (0.50) | ALDH1A1NPC1POLBRAB9AKDM4E |
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-109641886-A | bicyclic BET bromodomain inhibitors and uses thereof | 康威基内有限公司 | 2019-04-16 | — | — | CN | claimed |
| CN-109641886-A | bicyclic BET bromodomain inhibitors and uses thereof | 康威基内有限公司 | 2019-04-16 | — | — | CN | disclosed |