Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY1 | P47900 | 10/20 | 0.67 |
| ▸ | P2RX3 | P56373 | 5/20 | 0.67 |
| ▸ | P2RX1 | P51575 | 3/20 | 0.67 |
| ▸ | P2RY2 | P41231 | 2/20 | 0.67 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.67 |
| ▸ | P2RX2 | Q9UBL9 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | SRC | P12931 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.67 |
| ▸ | P2RY11 | Q96G91 | 2/20 | 0.63 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.63 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.63 |
| ▸ | MACROD2 | A1Z1Q3 | 1/20 | 0.63 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.63 |
| ▸ | MACROD1 | Q9BQ69 | 1/20 | 0.63 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.63 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.61 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.59 |
| ▸ | TGM2 | P21980 | 1/20 | 0.59 |
| ▸ | CA5A | P35218 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL625182 | 0.97 | P2RY1 (0.68) | P2RY1P2RX3P2RX1P2RY2P2RX4 | |
| SCHEMBL10454900 | 0.96 | P2RY1 (0.67) | P2RY1P2RX3P2RX1P2RY2P2RX4 | |
| Triphosphate SCHEMBL11811171 | 0.92 | CA5A (0.64) | P2RY1P2RX3P2RX1P2RY2P2RX4 | |
| SCHEMBL188740 | 0.92 | CA5A (0.68) | P2RY1P2RY2SRCSMN1; SMN2P2RY11 | |
| Ammonia Solution, Strong SCHEMBL4362929 | 0.91 | CA5A (0.67) | P2RY1P2RY2SRCSMN1; SMN2P2RY11 | |
| Guanosine Triphosphate SCHEMBL15900104 | 0.88 | P2RY1 (0.70) | P2RY1P2RX3P2RX1P2RY2P2RX4 | |
| Gtp SCHEMBL15900105 | 0.88 | P2RY1 (0.70) | P2RY1P2RX3P2RX1P2RY2P2RX4 | |
| SCHEMBL1942566 | 0.88 | RNASEL (0.68) | P2RY1P2RY2SRCSMN1; SMN2P2RY11 | |
| SCHEMBL15794408 | 0.87 | P2RY1 (0.79) | P2RY1P2RX3P2RX1P2RY2P2RX4 | |
| SCHEMBL1904678 | 0.87 | P2RY1 (0.66) | P2RY1P2RX3P2RX1P2RY2P2RX4 |
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 |
|---|---|---|---|---|---|---|---|
| US-20140309186-A1 | Metabolomics-Based Identification of Disease-Causing Agents | GEORGIA TECH RESEARCH CORPORATION | 2014-10-16 | — | — | US | disclosed |
| US-20110246081-A1 | Metabolomics-Based Identification of Disease-Causing Agents | GEORGIA TECH RESEARCH CORPORATION (US) | 2011-10-06 | — | — | US | disclosed |