Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | PTPRB | P23467 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL26932275 | 0.87 | TSHR (0.40) | HTTCYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL16680854 | 0.85 | CTSS (0.43) | CTSSCTSK | |
| SCHEMBL7635395 | 0.85 | HTT (0.44) | HTTCYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL16680852 | 0.85 | CTSS (0.43) | CTSSCTSK | |
| SCHEMBL25602513 | 0.85 | FAAH (0.43) | CYP1A2CYP2C9CYP2C19CTSSCTSK | |
| SCHEMBL7146561 | 0.84 | HTT (0.50) | HTTCYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL1274264 | 0.84 | TSHR (0.51) | HTTCYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL27763891 | 0.84 | TSHR (0.51) | HTTCYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL13929424 | 0.84 | TSHR (0.51) | HTTCYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL18640816 | 0.82 | TSHR (0.45) | HTTCYP1A2CYP2C9CYP2C19TSHR |
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-2011094890-A1 | PHENYLALANINE DERIVATIVES AND THEIR USE AS NON-PEPTIDE GLP-1 RECEPTOR MODULATORS | ARGUSINA INC. (US) | 2011-08-11 | — | — | WO | disclosed |