Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | IDH2 | P48735 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 2/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | RBP4 | P02753 | 2/20 | 0.35 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL9249687 | 1.00 | HTR2A (0.43) | HTR2AHTR2CHTR2BTDP1IDH2 | |
| SCHEMBL9254949 | 0.96 | HTR2A (0.43) | HTR2AHTR2CHTR2BTDP1IDH2 | |
| SCHEMBL9254954 | 0.96 | HTR2A (0.43) | HTR2AHTR2CHTR2BTDP1IDH2 | |
| SCHEMBL9254507 | 0.96 | HTR2A (0.46) | HTR2AHTR2CHTR2BTDP1IDH2 | |
| SCHEMBL9254510 | 0.96 | HTR2A (0.46) | HTR2AHTR2CHTR2BTDP1IDH2 | |
| SCHEMBL9256391 | 0.92 | HTR2A (0.45) | HTR2AHTR2CHTR2BTDP1IDH2 | |
| SCHEMBL9257061 | 0.92 | HTR2A (0.45) | HTR2AHTR2CHTR2BTDP1IDH2 | |
| SCHEMBL9257053 | 0.92 | HTR2A (0.45) | HTR2AHTR2CHTR2BTDP1IDH2 | |
| SCHEMBL9256397 | 0.92 | HTR2A (0.45) | HTR2AHTR2CHTR2BTDP1IDH2 | |
| SCHEMBL9261225 | 0.88 | HTR2A (0.48) | HTR2AHTR2CHTR2BTDP1IDH2 |
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-1995009829-A1 | 2,4-DIFLUOROBENZENES AND THEIR USE IN LIQUID CRYSTAL MIXTURES | MERCK PATENT GMBH (DE) | 1995-04-13 | — | — | WO | disclosed |