Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 11/20 | 0.55 |
| ▸ | P2RX2 | Q9UBL9 | 11/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 2/20 | 0.46 |
| ▸ | HTR2B | P41595 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | SI | P14410 | 1/20 | 0.41 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12889915 | 0.84 | GAA (0.57) | P2RX3P2RX2GAAPOLBGFER | |
| SCHEMBL23268676 | 0.82 | P2RX3 (0.44) | P2RX3P2RX2GAAPOLBGFER | |
| SCHEMBL531643 | 0.82 | P2RX3 (0.44) | P2RX3P2RX2GAAPOLBGFER | |
| SCHEMBL14200081 | 0.81 | GAA (0.57) | P2RX3P2RX2GAAPOLBGFER | |
| SCHEMBL2953510 | 0.81 | GAA (0.59) | P2RX3P2RX2GAAPOLBGFER | |
| SCHEMBL481617 | 0.78 | HTR2A (0.47) | P2RX3P2RX2GAAHTR1AHTR2A | |
| SCHEMBL21594781 | 0.78 | POLB (0.49) | P2RX3P2RX2GAAPOLBGFER | |
| SCHEMBL2482870 | 0.78 | P2RX3 (0.44) | P2RX3P2RX2HTR1AHTR2AHTR2C | |
| SCHEMBL12205020 | 0.76 | P2RX3 (0.53) | P2RX3P2RX2HTR1AHTR2AHTR2C | |
| SCHEMBL28211962 | 0.76 | HTR2A (0.50) | HTR1AHTR2AHTR2CHTR2BCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | disclosed |
| WO-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | disclosed |