Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.69 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | MAP3K11 | Q16584 | 2/20 | 0.50 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | AXL | P30530 | 1/20 | 0.44 |
| ▸ | CDK8 | P49336 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.44 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.43 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.43 |
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 SCHEMBL27740778 | 0.89 | NPC1 (0.51) | NPC1POLBRAB9AALDH1A1CA1 | |
| SCHEMBL30587350 | 0.83 | NPC1 (1.00) | NPC1MAP3K11CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL446619 | 0.83 | NPC1 (1.00) | NPC1MAP3K11CYP17A1CYP11B1CYP11B2 | |
| Quinoline SCHEMBL843861 | 0.81 | ALDH1A1 (0.63) | NPC1POLBRAB9AALDH1A1CA1 | |
| Quinoline SCHEMBL28816675 | 0.81 | ALDH1A1 (0.63) | NPC1POLBRAB9AALDH1A1CA1 | |
| Quinoline SCHEMBL28292512 | 0.81 | ALDH1A1 (0.63) | NPC1POLBRAB9AALDH1A1CA1 | |
| Quinoline SCHEMBL28073739 | 0.81 | ALDH1A1 (0.63) | NPC1POLBRAB9AALDH1A1CA1 | |
| Quinoline SCHEMBL29042459 | 0.81 | ALDH1A1 (0.58) | NPC1ALDH1A1CA1CA2AXL | |
| Quinoline SCHEMBL28746810 | 0.81 | ALDH1A1 (0.58) | NPC1RAB9AALDH1A1CA1CA2 | |
| Quinoline SCHEMBL27705544 | 0.81 | AHR (0.62) | NPC1POLBRAB9AALDH1A1CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109912488-A | The method that copper catalysis disactivation olefin alkylation is combined to 3- alkyl-indol quinoline | 昆明学院 | 2019-06-21 | — | — | CN | disclosed |