Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | BCHE | P06276 | 1/20 | 0.53 |
| ▸ | CCR4 | P51679 | 4/20 | 0.52 |
| ▸ | HTR7 | P34969 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.46 |
| ▸ | EP300 | Q09472 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | HTR6 | P50406 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1682296 | 0.87 | HTR2A (0.53) | BCHEEP300HIF1AHTR2AHTR2C | |
| SCHEMBL1682289 | 0.86 | SCN8A (0.49) | EP300HIF1AHTR2AHTR2CCHRM2 | |
| SCHEMBL1682317 | 0.85 | CHRM4 (0.50) | KMT2AHTR2AHTR2CCHRM2CHRM3 | |
| SCHEMBL1682312 | 0.85 | HTT (0.54) | ALDH1A1KMT2ASMN1; SMN2BCHECHRM2 | |
| SCHEMBL1682299 | 0.84 | KDM4E (0.49) | ALDH1A1KMT2AKDM4EHTR2AHTR2C | |
| SCHEMBL1682268 | 0.84 | USP2 (0.55) | ALDH1A1KMT2AKDM4EBCHEHTR7 | |
| SCHEMBL1682262 | 0.84 | CXCR4 (0.51) | ALDH1A1SMN1; SMN2BCHEHTR6CNR2 | |
| SCHEMBL1682260 | 0.84 | CXCR4 (0.48) | ALDH1A1SLC6A4EP300HIF1AHTR2A | |
| SCHEMBL1682284 | 0.83 | CNR2 (0.52) | ALDH1A1BCHECCR4HTR2AHTR2C | |
| SCHEMBL1682275 | 0.83 | BCHE (0.49) | BCHEHTR7EP300HIF1AHTR2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011043519-A2 | SULFONAMIDE DERIVATIVES AS SEROTONIN RECEPTOR ANTAGONIST AND SEROTONIN REUPTAKE INHIBITOR | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2011-04-14 | — | — | WO | claimed |
| WO-2011043519-A2 | SULFONAMIDE DERIVATIVES AS SEROTONIN RECEPTOR ANTAGONIST AND SEROTONIN REUPTAKE INHIBITOR | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2011-04-14 | — | — | WO | disclosed |