Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 2/20 | 0.50 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.50 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.49 |
| ▸ | PRKDC | P78527 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.45 |
| ▸ | CCR5 | P51681 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.43 |
| ▸ | SLCO1B1 | Q9Y6L6 | 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 | |
|---|---|---|---|---|
| SCHEMBL6602974 | 0.89 | HTR1A (0.44) | NPC1MAPTRAB9ALRRK2 | |
| SCHEMBL6608010 | 0.89 | PIK3CG (0.51) | ATRATRIPPIK3CGPRKDCALDH1A1 | |
| SCHEMBL6593434 | 0.88 | ALDH1A1 (0.49) | ALDH1A1GAAMAPTHSD17B10LRRK2 | |
| SCHEMBL6592999 | 0.87 | DRD2 (0.48) | ALDH1A1 | |
| SCHEMBL6080488 | 0.80 | SMN1; SMN2 (0.42) | ALDH1A1NPC1MAPTRAB9ALRRK2 | |
| SCHEMBL6080127 | 0.79 | ALDH1A1 (0.49) | ALDH1A1GAAMAPTHSD17B10LRRK2 | |
| SCHEMBL6594774 | 0.78 | SMN1; SMN2 (0.46) | NPC1MAPTRAB9ALRRK2 | |
| SCHEMBL6590520 | 0.78 | MRGPRX4 (0.47) | — | |
| SCHEMBL6596767 | 0.78 | MRGPRX4 (0.47) | NPC1MAPTRAB9A | |
| SCHEMBL6080355 | 0.77 | BACE1 (0.49) | ALDH1A1HSD17B10 |
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-1451159-A1 | COMPOSITIONS DERIVED FROM QUINOLINE AND QUINOXALINE, PREPARATION AND USE THEREOF | NEURO3D (FR) | 2004-09-01 | — | — | EP | disclosed |
| WO-2003010146-A1 | COMPOSITIONS DERIVED FROM QUINOLINE AND QUINOXALINE, PREPARATION AND USE THEREOF | NEURO3D (FR) | 2003-02-06 | — | — | WO | disclosed |