Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Quinoline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.71 |
| ▸ | CASP1 | P29466 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
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 SCHEMBL3432255 | 0.98 | ALDH1A1 (0.74) | ALDH1A1CASP1HTTSMN1; SMN2KDM4E | |
| Quinoline SCHEMBL3433988 | 0.96 | ALDH1A1 (0.71) | ALDH1A1CASP1HTTSMN1; SMN2KDM4E | |
| Quinoline SCHEMBL3433990 | 0.96 | ALDH1A1 (0.71) | ALDH1A1CASP1HTTSMN1; SMN2KDM4E | |
| Quinoline SCHEMBL2535469 | 0.89 | ALDH1A1 (0.81) | ALDH1A1CASP1HTTSMN1; SMN2KDM4E | |
| Quinoline SCHEMBL4599170 | 0.87 | ALDH1A1 (0.77) | ALDH1A1CASP1HTTSMN1; SMN2KDM4E | |
| Quinoline SCHEMBL27960167 | 0.87 | ALDH1A1 (0.77) | ALDH1A1CASP1HTTSMN1; SMN2KDM4E | |
| Quinoline SCHEMBL2313500 | 0.87 | ALDH1A1 (0.85) | ALDH1A1CASP1HTTSMN1; SMN2KDM4E | |
| Quinoline SCHEMBL27834738 | 0.87 | ALDH1A1 (0.85) | ALDH1A1CASP1HTTSMN1; SMN2KDM4E | |
| Quinoline SCHEMBL867374 | 0.87 | ALDH1A1 (0.94) | ALDH1A1CASP1HTTSMN1; SMN2KDM4E | |
| Quinoline SCHEMBL4955314 | 0.87 | ALDH1A1 (0.94) | ALDH1A1CASP1HTTSMN1; SMN2KDM4E |
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-110491996-A | A kind of Two-dimensional Carbon based perovskite solar battery based on aminoquinolines ionic liquid | UNIV SOUTH CENTRAL NATIONALITI | 2019-11-22 | — | — | CN | claimed |
| CN-110491996-A | A kind of Two-dimensional Carbon based perovskite solar battery based on aminoquinolines ionic liquid | UNIV SOUTH CENTRAL NATIONALITI | 2019-11-22 | — | — | CN | disclosed |