Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 3/20 | 0.42 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9223448 | 1.00 | PARP10 (0.42) | PARP10PARP15SCN9ATDP1FFAR4 | |
| SCHEMBL9225857 | 0.96 | PARP10 (0.41) | PARP10PARP15SCN9ATDP1FFAR4 | |
| SCHEMBL9225852 | 0.96 | PARP10 (0.41) | PARP10PARP15SCN9ATDP1FFAR4 | |
| SCHEMBL9221776 | 0.96 | PARP10 (0.45) | PARP10PARP15SCN9ATDP1FFAR4 | |
| SCHEMBL9221785 | 0.96 | PARP10 (0.45) | PARP10PARP15SCN9ATDP1FFAR4 | |
| SCHEMBL9221503 | 0.92 | PARP10 (0.44) | PARP10PARP15SCN9ATDP1FFAR4 | |
| SCHEMBL9221886 | 0.92 | PARP10 (0.44) | PARP10PARP15SCN9ATDP1FFAR4 | |
| SCHEMBL9221511 | 0.92 | PARP10 (0.44) | PARP10PARP15SCN9ATDP1FFAR4 | |
| SCHEMBL9221882 | 0.92 | PARP10 (0.44) | PARP10PARP15SCN9ATDP1FFAR4 | |
| SCHEMBL9227652 | 0.88 | PARP10 (0.47) | PARP10PARP15SCN9ATDP1FFAR4 |
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-1995009827-A1 | 3,4-DIFLUOROBENZENES AND THEIR USE IN LIQUID-CRYSTAL MIXTURES | MERCK PATENT GMBH (DE) | 1995-04-13 | — | — | WO | disclosed |