Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 2/20 | 0.34 |
| ▸ | HTR1B | P28222 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | FPR2 | P25090 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | THRA | P10827 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.32 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | HTR2B | P41595 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL9630343 | 1.00 | SCN9A (0.35) | SCN9AHTR1DHTR1BCNR1CNR2 | |
| SCHEMBL9406427 | 0.99 | CNR1 (0.36) | SCN9AHTR1DHTR1BCNR1CNR2 | |
| SCHEMBL9406431 | 0.99 | CNR1 (0.36) | SCN9AHTR1DHTR1BCNR1CNR2 | |
| SCHEMBL9632439 | 0.96 | SCN9A (0.34) | SCN9AHTR1DHTR1BCNR1CNR2 | |
| SCHEMBL9631157 | 0.96 | SCN9A (0.34) | SCN9AHTR1DHTR1BCNR1CNR2 | |
| SCHEMBL9632443 | 0.96 | SCN9A (0.34) | SCN9AHTR1DHTR1BCNR1CNR2 | |
| SCHEMBL9631162 | 0.96 | SCN9A (0.34) | SCN9AHTR1DHTR1BCNR1CNR2 | |
| SCHEMBL25693792 | 0.96 | SCN9A (0.38) | SCN9AHTR1DHTR1BL3MBTL1HTR2C | |
| SCHEMBL19985183 | 0.95 | CNR1 (0.34) | SCN9AHTR1DHTR1BCNR1CNR2 | |
| SCHEMBL19985464 | 0.95 | ALOX5AP (0.33) | SCN9AHTR1DHTR1BCNR1CNR2 |
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 |