Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 6/20 | 0.79 |
| ▸ | P2RY1 | P47900 | 6/20 | 0.73 |
| ▸ | P2RY11 | Q96G91 | 4/20 | 0.73 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.68 |
| ▸ | CA1 | P00915 | 1/20 | 0.68 |
| ▸ | CA2 | P00918 | 1/20 | 0.68 |
| ▸ | CA4 | P22748 | 1/20 | 0.68 |
| ▸ | CA9 | Q16790 | 1/20 | 0.68 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.66 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.66 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.66 |
| ▸ | CA5A | P35218 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL10120960 | 0.90 | P2RY1 (0.83) | NT5EP2RY1P2RY11ADORA3CA1 | |
| SCHEMBL8423402 | 0.90 | P2RY1 (0.83) | NT5EP2RY1P2RY11ADORA3CA1 | |
| SCHEMBL8423419 | 0.90 | P2RY1 (0.83) | NT5EP2RY1P2RY11ADORA3CA1 | |
| SCHEMBL9200558 | 0.88 | NT5E (1.00) | NT5EP2RY1P2RY11 | |
| SCHEMBL17202531 | 0.86 | NT5E (0.72) | NT5EP2RY1P2RY11ADORA3CA1 | |
| SCHEMBL17206187 | 0.86 | NT5E (0.72) | NT5EP2RY1P2RY11ADORA3CA1 | |
| SCHEMBL17202535 | 0.86 | NT5E (0.72) | NT5EP2RY1P2RY11ADORA3CA1 | |
| SCHEMBL17203126 | 0.86 | NT5E (0.72) | NT5EP2RY1P2RY11ADORA3CA1 | |
| SCHEMBL17213334 | 0.86 | NT5E (0.72) | NT5EP2RY1P2RY11ADORA3CA1 | |
| SCHEMBL2025155 | 0.86 | P2RY1 (0.87) | NT5EP2RY1P2RY11ADORA3CA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8119364-B2 | Methods for generating analogs of coenzyme A | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2012-02-21 | — | — | US | disclosed |
| US-20100304430-A1 | Methods for Generating Analogs of Coenzyme A | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2010-12-02 | — | — | US | disclosed |
| US-7727738-B2 | Methods for generating analogs of coenzyme A | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2010-06-01 | — | — | US | disclosed |
| US-20070128683-A1 | Metabolic delivery of coenzyme A analogs | NATIONAL SCIENCE FOUNDATION | 2007-06-07 | — | — | US | disclosed |