Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK1E | P49674 | 1/20 | 0.54 |
| ▸ | MMP2 | P08253 | 16/20 | 0.41 |
| ▸ | MMP3 | P08254 | 11/20 | 0.41 |
| ▸ | MMP1 | P03956 | 10/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MMP7 | P09237 | 6/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL28853748 | 0.98 | CSNK1E (0.52) | CSNK1EMMP2MMP3MMP1HTR2A | |
| Hydrochloric Acid SCHEMBL27825938 | 0.98 | CSNK1E (0.52) | CSNK1EMMP2MMP3MMP1HTR2A | |
| SCHEMBL2392222 | 0.98 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1HTR2A | |
| SCHEMBL8386222 | 0.98 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1HTR2A | |
| SCHEMBL8387575 | 0.98 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1HTR2A | |
| SCHEMBL25283495 | 0.98 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1HTR2A | |
| SCHEMBL337801 | 0.98 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1HTR2A | |
| SCHEMBL8383203 | 0.98 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1HTR2A | |
| SCHEMBL2394133 | 0.98 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1HTR2A | |
| SCHEMBL25287896 | 0.98 | CSNK1E (0.55) | CSNK1EMMP2MMP3MMP1HTR2A |
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-109422839-A | Polystyrene-ethylene base benzyldimethyldodecylammonium ammonium chloride-composite titania material and preparation method | 天津大学 | 2019-03-05 | — | — | CN | disclosed |