Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 13/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | FPR1 | P21462 | 1/20 | 0.40 |
| ▸ | FPR3 | P25089 | 1/20 | 0.40 |
| ▸ | GPR183 | P32249 | 1/20 | 0.40 |
| ▸ | APLNR | P35414 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28359812 | 0.88 | FFAR1 (0.44) | FFAR1CYP2A6CHRM2S1PR1FPR1 | |
| SCHEMBL28509989 | 0.80 | CA12 (0.51) | FFAR1CYP2A6CHRM2S1PR1FPR1 | |
| SCHEMBL8449935 | 0.79 | FFAR1 (0.60) | FFAR1CYP2A6CHRM2S1PR1FPR1 | |
| SCHEMBL28515436 | 0.77 | FFAR1 (0.47) | FFAR1CYP2A6CHRM2S1PR1FPR1 | |
| SCHEMBL29985519 | 0.77 | MAPT (0.63) | FFAR1CYP2A6CHRM2S1PR1FPR1 | |
| SCHEMBL2831073 | 0.77 | TP53 (0.59) | FFAR1CYP2A6FFAR4TP53ACACB | |
| SCHEMBL5050178 | 0.77 | CYP2A6 (0.64) | FFAR1CYP2A6TP53ACACB | |
| SCHEMBL8228398 | 0.77 | CYP2A6 (0.64) | FFAR1CYP2A6TP53ACACB | |
| SCHEMBL28513833 | 0.77 | CYP1A2 (0.38) | FFAR1MMP2MMP9 | |
| SCHEMBL28520410 | 0.77 | KCNH2 (0.42) | FFAR1SLC6A4 |
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-110656346-B | Method for continuously preparing 2-aryl-3-halogenated-benzothiophene compound by using electrochemical microchannel reaction device | 南京工业大学 | 2021-02-02 | — | — | CN | claimed |