Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NCF1 | P14598 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
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 SCHEMBL28264935 | 0.91 | ALDH1A1 (0.50) | NPC1RAB9ACYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL3213359 | 0.89 | CYP3A4 (0.42) | NPC1RAB9ACYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL3219342 | 0.78 | CYP3A4 (0.42) | RAB9AALDH1A1CYP3A4MAPK1SMN1; SMN2 | |
| SCHEMBL7028380 | 0.75 | HTR2A (0.52) | — | |
| SCHEMBL329691 | 0.75 | CYP1A2 (0.50) | NCF1CYP1A2NOS2BACE1CA12 | |
| SCHEMBL11679239 | 0.75 | NCF1 (0.45) | NPC1RAB9ANCF1CYP1A2NOS2 | |
| SCHEMBL546320 | 0.73 | MGAM (0.47) | NPC1RAB9ANCF1CYP1A2NOS2 | |
| SCHEMBL14194322 | 0.73 | NCF1 (0.43) | NPC1RAB9ANCF1CYP1A2NOS2 | |
| SCHEMBL645967 | 0.73 | NCF1 (0.48) | NPC1RAB9ANCF1CYP1A2NOS2 | |
| SCHEMBL5609339 | 0.73 | NCF1 (0.43) | NPC1RAB9ANCF1CYP1A2NOS2 |
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-109134364-B | Synthesis method of 2-aliphatic sulfonyl quinoline derivative | 中南大学 | 2020-05-05 | — | — | CN | disclosed |
| CN-109134364-A | A kind of synthetic method of 2- aliphaticsulfonyl quinoline | 中南大学 | 2019-01-04 | — | — | CN | disclosed |