Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 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 | |
|---|---|---|---|---|
| SCHEMBL13410217 | 0.90 | TSHR (0.50) | TSHRGABRA1GABRB2FAAHCA1 | |
| SCHEMBL31028132 | 0.85 | GABRA1 (0.59) | TSHRGABRA1GABRB2FAAHCA1 | |
| SCHEMBL10486191 | 0.85 | GABRA1 (0.59) | TSHRGABRA1GABRB2FAAHCA1 | |
| SCHEMBL7066182 | 0.85 | GABRA1 (0.59) | TSHRGABRA1GABRB2FAAHCA1 | |
| SCHEMBL9161857 | 0.85 | GABRA1 (0.43) | TSHRGABRA1GABRB2FAAHCA1 | |
| SCHEMBL560318 | 0.82 | TSHR (0.68) | TSHRGABRA1GABRB2FAAHCA1 | |
| SCHEMBL560346 | 0.82 | TSHR (0.68) | TSHRGABRA1GABRB2FAAHCA1 | |
| SCHEMBL561299 | 0.82 | TSHR (0.68) | TSHRGABRA1GABRB2FAAHCA1 | |
| SCHEMBL202738 | 0.82 | TSHR (0.68) | TSHRGABRA1GABRB2FAAHCA1 | |
| SCHEMBL19254463 | 0.81 | TSHR (0.55) | TSHRGABRA1GABRB2ADRA2AADRA2B |
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-2011019747-A1 | COMPOSITIONS AND METHODS OF TREATING CHRONIC PAIN BY ADMINISTERING PROPOFOL DERIVATIVES | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2011-02-17 | — | — | WO | disclosed |