Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 1/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23630298 | 1.00 | CCR4 (0.41) | CCR4HCRTR1HCRTR2CNR1NR1D1 | |
| SCHEMBL23630601 | 0.90 | CCR4 (0.40) | CCR4HCRTR1HCRTR2CNR1NR1D1 | |
| SCHEMBL29948257 | 0.90 | CCR4 (0.40) | CCR4HCRTR1HCRTR2CNR1NR1D1 | |
| SCHEMBL23630431 | 0.88 | NR1D1 (0.41) | CCR4HCRTR1HCRTR2CNR1NR1D1 | |
| SCHEMBL30225361 | 0.88 | NR1D1 (0.41) | CCR4HCRTR1HCRTR2CNR1NR1D1 | |
| SCHEMBL29948245 | 0.88 | NR1D1 (0.41) | CCR4HCRTR1HCRTR2CNR1NR1D1 | |
| SCHEMBL29948239 | 0.88 | NR1D1 (0.41) | CCR4HCRTR1HCRTR2CNR1NR1D1 | |
| SCHEMBL29948294 | 0.78 | NSD2 (0.51) | MEN1KMT2AALDH1A1KDM4EHTR6 | |
| SCHEMBL23630294 | 0.78 | NSD2 (0.51) | MEN1KMT2AALDH1A1KDM4EHTR6 | |
| SCHEMBL3685348 | 0.71 | NSD2 (0.40) | ALDH1A1KDM4ENPSR1HTR6TSHR |
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-2021141506-A1 | AROMATIC SULPHONAMIDES DERIVATIVES THAT INHIBITS PDI A1, THEIR SYNTHESIS AND USE | Uniwersytet Jagielloński (PL) | 2021-07-15 | — | — | WO | disclosed |
| WO-2021141507-A1 | AROMATIC SULPHONAMIDES DERIVATIVES THAT INHIBITS PDI A3, THEIR SYNTHESIS AND USE | Uniwersytet Jagielloński (PL) | 2021-07-15 | — | — | WO | disclosed |