Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 2/20 | 0.34 |
| ▸ | HTR1B | P28222 | 2/20 | 0.34 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 4/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9631507 | 1.00 | SCN9A (0.37) | SCN9ACYP2C9PPARGHTR1DHTR1B | |
| SCHEMBL4402652 | 0.99 | SCN9A (0.38) | SCN9ACYP2C9PPARGHTR1DHTR1B | |
| SCHEMBL26209537 | 0.99 | SCN9A (0.38) | SCN9ACYP2C9PPARGHTR1DHTR1B | |
| SCHEMBL9632575 | 0.96 | SCN9A (0.34) | SCN9ACYP2C9PPARGHTR1DHTR1B | |
| SCHEMBL9632579 | 0.96 | SCN9A (0.34) | SCN9ACYP2C9PPARGHTR1DHTR1B | |
| SCHEMBL9630413 | 0.95 | CNR1 (0.35) | SCN9ACYP2C9PPARGHTR1DHTR1B | |
| SCHEMBL14235296 | 0.95 | SCN9A (0.36) | SCN9ACYP2C9PPARGHTR1DHTR1B | |
| SCHEMBL9630415 | 0.95 | CNR1 (0.35) | SCN9ACYP2C9PPARGHTR1DHTR1B | |
| SCHEMBL26209558 | 0.95 | SCN9A (0.36) | SCN9ACYP2C9PPARGHTR1DHTR1B | |
| SCHEMBL9631624 | 0.95 | SCN9A (0.35) | SCN9ACYP2C9PPARGHTR1DHTR1B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0364538-B1 | DIFLUOROBENZOL DERIVATIVES | MERCK PATENT GmbH (DE) | 1992-05-06 | — | — | EP | disclosed |