Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14962429 | 0.90 | — | — | |
| Trifluoroacetic Acid SCHEMBL27779373 | 0.90 | DPP4 (0.33) | PKM | |
| Hydrochloric Acid SCHEMBL14956310 | 0.89 | ADRB2 (0.31) | — | |
| SCHEMBL14955967 | 0.82 | HTR2A (0.33) | HTR2AHTR2C | |
| Trifluoroacetic Acid SCHEMBL27861532 | 0.81 | HRH4 (0.32) | PKMHRH4 | |
| Trifluoroacetic Acid SCHEMBL27779691 | 0.79 | UHRF1 (0.34) | PKMHRH4 | |
| SCHEMBL10025712 | 0.78 | SCN9A (0.33) | HTR2AHTR2C | |
| SCHEMBL2858951 | 0.78 | HTR2A (0.32) | HTR2AHTR2C | |
| SCHEMBL10025558 | 0.77 | DPP4 (0.43) | PKMHTR2AHTR2C | |
| Trifluoroacetic Acid SCHEMBL27779335 | 0.77 | TGFBR1 (0.40) | HTR2AHTR2C |
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 |
|---|---|---|---|---|---|---|---|
| CN-101641360-A | Piperazine derivatives, preparation method and medical application thereof | SHANGHAI HENGRUI PHARM CO LTD | 2010-02-03 | — | — | CN | disclosed |