Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | LMNA | P02545 | 5/20 | 0.48 |
| ▸ | GAA | P10253 | 4/20 | 0.48 |
| ▸ | HTT | P42858 | 5/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.46 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.45 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.45 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.45 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.45 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.45 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6160557 | 0.78 | NUDT1 (0.52) | ALDH1A1MAPTKDM4ENPSR1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL6161091 | 0.71 | NUDT1 (0.55) | LMNAHTTPOLBMAPTKDM4E | |
| SCHEMBL6159581 | 0.69 | NUDT1 (0.63) | LMNAMAPTNUDT1GRIN2DGRIN3B | |
| Hydrochloric Acid SCHEMBL6162260 | 0.68 | NUDT1 (0.61) | LMNAMAPTNUDT1GRIN2DGRIN3B | |
| SCHEMBL18029399 | 0.68 | PSMD14 (0.59) | ALDH1A1LMNAHTTPOLBMAPT | |
| SCHEMBL8035380 | 0.67 | LMNA (0.44) | ALDH1A1LMNAGAAHTTPOLB | |
| SCHEMBL10094645 | 0.67 | GRIN2D (0.68) | ALDH1A1LMNAHTTGRIN2DGRIN3B | |
| SCHEMBL23359957 | 0.67 | ALDH1A1 (0.51) | ALDH1A1LMNAGAAHTTPOLB | |
| SCHEMBL10650819 | 0.67 | PKM (0.62) | ALDH1A1LMNAGAAHTTPOLB | |
| SCHEMBL28169008 | 0.67 | ALDH1A1 (0.49) | ALDH1A1LMNAGAAHTTPOLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0993449-A1 | QUINOLINE DERIVATIVES AS PDE IV AND/OR TNF INHIBITORS | Darwin Discovery Limited (GB) | 2000-04-19 | — | — | EP | claimed |
| WO-1998057936-A1 | QUINOLINE DERIVATIVES AS PDE IV AND/OR TNF INHIBITORS | DARWIN DISCOVERY LIMITED (GB) | 1998-12-23 | — | — | WO | claimed |
| US-6069151-A | Quinolines and their therapeutic use | DARWIN DISCOVERY, LTD. (GB) | 2000-05-30 | — | — | US | disclosed |