Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.51 |
| ▸ | CCR8 | P51685 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | MMP14 | P50281 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL31426926 | 0.81 | AXL (0.41) | CCR1CCR8L3MBTL1ALDH1A1KDM4E | |
| SCHEMBL28889099 | 0.75 | AHR (0.48) | ALDH1A1CYP1A2AHRNR4A2IKBKB | |
| SCHEMBL10829012 | 0.75 | PARP1 (0.47) | CCR1CCR8L3MBTL1ALDH1A1KDM4E | |
| SCHEMBL2559892 | 0.70 | PARP1 (0.43) | L3MBTL1ALDH1A1LMNAHSP90AA1AXL | |
| SCHEMBL2087722 | 0.69 | MAPT (0.54) | ALDH1A1KDM4ELMNAHSP90AA1MAPT | |
| SCHEMBL29852620 | 0.69 | MAPT (0.54) | ALDH1A1KDM4ELMNAHSP90AA1MAPT | |
| SCHEMBL8600442 | 0.69 | AXL (0.46) | KDM4ELMNAMAPTAXLNUDT1 | |
| SCHEMBL3167612 | 0.69 | CCR1 (0.53) | CCR1CCR8L3MBTL1ALDH1A1KDM4E | |
| SCHEMBL1159986 | 0.68 | LMNA (0.58) | CCR1CCR8L3MBTL1ALDH1A1KDM4E | |
| SCHEMBL504765 | 0.68 | CCR1 (1.00) | CCR1CCR8L3MBTL1ALDH1A1KDM4E |
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-1109809-B1 | PYRROLOQUINOLINES FOR TREATMENT OF OBESITY | CEREBRUS PHARM LTD (GB) | 2004-11-17 | — | — | EP | disclosed |
| US-6365598-B1 | FOR THERAPY AND PROPHYLAXIS OF DISORDERS OF THE CENTRAL NERVOUS SYSTEM; DAMAGE TO THE CENTRAL NERVOUS SYSTEM; CARDIOVASCULAR DISORDERS; GASTROINTESTINAL DISORDERS; DIABETES INSIPIDUS; AND SLEEP APNEA | VERNALIS RESEARCH LIMITED (GB) | 2002-04-02 | — | — | US | disclosed |