Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 13/20 | 0.81 |
| ▸ | HTR2C | P28335 | 10/20 | 0.81 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.71 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
| ▸ | MMP16 | P51512 | 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 | |
|---|---|---|---|---|
| SCHEMBL3172177 | 1.00 | HTR2A (0.81) | HTR2AHTR2CKCNH2NFE2L2CYP2D6 | |
| SCHEMBL3157651 | 0.90 | HTR2A (1.00) | HTR2AHTR2CKCNH2NFE2L2CYP2D6 | |
| SCHEMBL3157660 | 0.90 | HTR2A (1.00) | HTR2AHTR2CKCNH2NFE2L2CYP2D6 | |
| SCHEMBL3166639 | 0.90 | HTR2A (0.80) | HTR2AHTR2CKCNH2NFE2L2CYP2D6 | |
| SCHEMBL3166649 | 0.90 | HTR2A (0.80) | HTR2AHTR2CKCNH2NFE2L2CYP2D6 | |
| SCHEMBL3162397 | 0.88 | CYP2D6 (0.63) | HTR2AHTR2CKCNH2NFE2L2CYP2D6 | |
| SCHEMBL3162407 | 0.88 | CYP2D6 (0.63) | HTR2AHTR2CKCNH2NFE2L2CYP2D6 | |
| SCHEMBL3152195 | 0.87 | HTR2A (0.75) | HTR2AHTR2CKCNH2NFE2L2CYP2D6 | |
| SCHEMBL3159665 | 0.87 | HTR2A (0.75) | HTR2AHTR2CKCNH2NFE2L2CYP2D6 | |
| SCHEMBL3151910 | 0.84 | HTR2A (0.72) | HTR2AHTR2CKCNH2NFE2L2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1807393-B1 | DIARYLSULFONES AS 5-HT2A ANTAGONISTS | MERCK SHARP & DOHME (GB) | 2010-03-31 | — | — | EP | claimed |