Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | NOS3 | P29474 | 4/20 | 0.40 |
| ▸ | NOS1 | P29475 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | NOS2 | P35228 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20173402 | 0.84 | CYP2C9 (0.50) | CYP2C9ADRA2AADRA2BADRA2CTSHR | |
| SCHEMBL13083301 | 0.82 | ALDH1A1 (0.49) | CYP2C9ADRA2AADRA2BADRA2CTSHR | |
| SCHEMBL20175858 | 0.81 | ADRA2A (0.49) | CYP2C9ADRA2AADRA2BADRA2CNOS3 | |
| SCHEMBL24227104 | 0.76 | NOS1 (0.37) | ADRA2AADRA2BADRA2CTSHRNOS3 | |
| SCHEMBL4981748 | 0.74 | CYP2C9 (0.48) | CYP2C9ADRA2AADRA2BADRA2CNOS3 | |
| SCHEMBL8397445 | 0.72 | CYP2C9 (0.49) | CYP2C9ADRA2AADRA2BADRA2CTSHR | |
| Hydrogen Peroxide SCHEMBL11434421 | 0.72 | ALDH1A1 (0.59) | CYP2C9TSHRALDH1A1GAAUSP2 | |
| SCHEMBL598140 | 0.72 | ALDH1A1 (0.52) | CYP2C9TSHRALDH1A1GAAUSP2 | |
| SCHEMBL15159798 | 0.71 | HTR3E (0.52) | CYP2C9ADRA2AADRA2BADRA2CTSHR | |
| SCHEMBL15153262 | 0.71 | HTR3E (0.52) | CYP2C9ADRA2AADRA2BADRA2CTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20180142117-A1 | SWITCHABLE WATER-BASED PAINT OR COATING COMPOSITIONS | GREENCENTRE CANADA (CA) | 2018-05-24 | — | — | US | disclosed |