Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | P2RY12 | Q9H244 | 16/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ACACB | O00763 | 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 | |
|---|---|---|---|---|
| SCHEMBL3930058 | 0.93 | ALDH1A1 (0.65) | ALDH1A1P2RY12KDM4ENPSR1ACACB | |
| SCHEMBL5423937 | 0.87 | ALDH1A1 (0.51) | ALDH1A1P2RY12KDM4ENPSR1ACACB | |
| SCHEMBL4425609 | 0.81 | ALDH1A1 (0.84) | ALDH1A1P2RY12KDM4ENPSR1 | |
| SCHEMBL4104450 | 0.74 | P2RY12 (0.68) | ALDH1A1P2RY12 | |
| SCHEMBL3926740 | 0.73 | ALDH1A1 (1.00) | ALDH1A1P2RY12KDM4ENPSR1 | |
| SCHEMBL30999844 | 0.73 | ALDH1A1 (1.00) | ALDH1A1P2RY12KDM4ENPSR1 | |
| SCHEMBL4117402 | 0.72 | P2RY12 (0.69) | ALDH1A1P2RY12 | |
| SCHEMBL4094945 | 0.72 | P2RY12 (0.68) | P2RY12 | |
| SCHEMBL4105670 | 0.72 | P2RY12 (0.46) | P2RY12 | |
| SCHEMBL4097642 | 0.70 | P2RY12 (0.86) | P2RY12 |
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-1836189-A1 | NOVEL PYRIDINE COMPOUNDS | AstraZeneca AB (SE) | 2007-09-26 | — | — | EP | disclosed |
| WO-2006073361-A1 | NOVEL PYRIDINE COMPOUNDS | ASTRAZENECA AB (SE) | 2006-07-13 | — | — | WO | disclosed |