Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.46 |
| ▸ | CDK9 | P50750 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6080920 | 0.81 | PDE10A (0.50) | PDE10ACDK9DYRK1ATNKSTNKS2 | |
| SCHEMBL6080957 | 0.75 | PDE10A (0.52) | PDE10ACDK9DYRK1ATNKSTNKS2 | |
| SCHEMBL6080303 | 0.73 | KDM5B (0.36) | ADORA2A | |
| SCHEMBL6081023 | 0.72 | KDM4E (0.52) | PDE10ACDK9DYRK1ATNKSTNKS2 | |
| SCHEMBL27276202 | 0.72 | CA12 (0.50) | PDE10ACDK9DYRK1ATNKSTNKS2 | |
| SCHEMBL6594661 | 0.72 | DUSP3 (0.41) | KDM4EALDH1A1ALOX15MEN1GAA | |
| SCHEMBL17966023 | 0.71 | ADORA2A (0.61) | ADORA2A | |
| SCHEMBL24010068 | 0.70 | KDM4E (0.47) | KDM4EALDH1A1HPGDHSD17B10THRB | |
| SCHEMBL2924449 | 0.70 | NQO2 (0.59) | PDE10ATNKSTNKS2PARP2ALDH1A1 | |
| SCHEMBL6081016 | 0.70 | PDE10A (0.56) | PDE10ACDK9DYRK1ATNKSTNKS2 |
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 |