Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY12 | Q9H244 | 5/20 | 0.39 |
| ▸ | P2RY2 | P41231 | 3/20 | 0.38 |
| ▸ | P2RY1 | P47900 | 2/20 | 0.38 |
| ▸ | P2RX3 | P56373 | 4/20 | 0.38 |
| ▸ | P2RX4 | Q99571 | 4/20 | 0.38 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.38 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.38 |
| ▸ | NT5E | P21589 | 2/20 | 0.37 |
| ▸ | DNPH1 | O43598 | 1/20 | 0.37 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.37 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.37 |
| ▸ | LDHA | P00338 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.37 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL19987164 | 0.89 | CYP3A4 (0.44) | P2RY12P2RY2P2RY1P2RX3P2RX4 | |
| SCHEMBL19987288 | 0.83 | CYP3A4 (0.44) | P2RY12P2RY2P2RY1P2RX3P2RX4 | |
| SCHEMBL19987167 | 0.82 | CYP3A4 (0.43) | P2RY12P2RX3P2RX4P2RX2DNPH1 | |
| SCHEMBL19987260 | 0.81 | P2RY12 (0.39) | P2RY12P2RY2P2RY1P2RX3P2RX4 | |
| SCHEMBL21511161 | 0.80 | CYP3A4 (0.43) | P2RY12P2RY2P2RY1P2RX3P2RX4 | |
| SCHEMBL21511203 | 0.79 | CYP3A4 (0.40) | — | |
| SCHEMBL19987222 | 0.75 | CYP3A4 (0.43) | P2RY12P2RX3P2RX4P2RX1P2RX2 | |
| SCHEMBL19987308 | 0.74 | CYP3A4 (0.45) | P2RY12DNPH1 | |
| SCHEMBL21511201 | 0.74 | CYP3A4 (0.45) | P2RY12DNPH1 | |
| SCHEMBL19987218 | 0.74 | CYP3A4 (0.45) | P2RY12DNPH1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018049535-A1 | NUCLEOSIDE ANALOGUES AND METHODS OF USE THEREOF | LCB PHARMA INC. (CA) | 2018-03-22 | — | — | WO | disclosed |