Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.63 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.44 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
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 SCHEMBL27764565 | 0.89 | ALDH1A1 (0.63) | ALDH1A1NPC1RAB9APOLBHTT | |
| Quinoline SCHEMBL542500 | 0.87 | ALDH1A1 (0.61) | ALDH1A1NPC1RAB9APOLBHTT | |
| Quinoline SCHEMBL27595438 | 0.85 | ALDH1A1 (0.46) | ALDH1A1NPC1RAB9APOLBHTT | |
| Quinoxaline SCHEMBL997539 | 0.84 | HTT (0.39) | ALDH1A1POLBHTTSMN1; SMN2LMNA | |
| Quinoline SCHEMBL27543949 | 0.84 | ALDH1A1 (0.81) | ALDH1A1NPC1RAB9APOLBHTT | |
| Quinoline SCHEMBL27422586 | 0.82 | ALDH1A1 (0.85) | ALDH1A1NPC1RAB9APOLBHTT | |
| Quinoline SCHEMBL9374715 | 0.81 | ALDH1A1 (0.68) | ALDH1A1NPC1RAB9APOLBHTT | |
| Quinoline SCHEMBL1416620 | 0.81 | ALDH1A1 (0.68) | ALDH1A1NPC1RAB9APOLBHTT | |
| Quinoline SCHEMBL21535 | 0.80 | ALDH1A1 (0.74) | ALDH1A1NPC1RAB9APOLBHTT | |
| Quinoline SCHEMBL259771 | 0.80 | ALDH1A1 (0.74) | ALDH1A1NPC1RAB9APOLBHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0531033-A1 | Corrosion inhibitor composition | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 1993-03-10 | — | — | EP | disclosed |
| US-5158693-A | Oligoquinolinium metal oxide salts as sulfur corrosion inhibitors | EXXON RESEARCH AND ENGINEERING CO. (US) | 1992-10-27 | — | — | US | disclosed |