Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A13 | Q16696 | 5/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | HRH2 | P25021 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22711499 | 1.00 | CYP2A13 (0.42) | CYP2A13HTTRECQLDRD4DRD2 | |
| SCHEMBL22711461 | 0.85 | SMN1; SMN2 (0.43) | HTTRECQLCCR5MEN1ALDH1A1 | |
| SCHEMBL23039625 | 0.84 | CYP2A13 (0.46) | CYP2A13HTTRECQLDRD4CCR5 | |
| SCHEMBL30697121 | 0.84 | CYP2A13 (0.46) | CYP2A13HTTRECQLDRD4CCR5 | |
| SCHEMBL30696977 | 0.83 | HTT (0.45) | HTTRECQLPDCD1CD274KDM4E | |
| SCHEMBL22711458 | 0.83 | HTT (0.45) | HTTRECQLPDCD1CD274KDM4E | |
| SCHEMBL22711411 | 0.79 | HTT (0.46) | HTTCCR5KMT2A | |
| SCHEMBL22711401 | 0.78 | CYP2A13 (0.56) | CYP2A13HTTRECQLDRD4CCR5 | |
| SCHEMBL30697124 | 0.78 | CYP2A13 (0.56) | CYP2A13HTTRECQLDRD4CCR5 | |
| SCHEMBL22711460 | 0.76 | HRH3 (0.46) | CCR5MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-111655685-B | Thiophene derivative and use thereof | 藤本株式会社 | 2023-11-17 | — | — | CN | disclosed |