Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.52 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28559507 | 1.00 | KMT2A (0.58) | KMT2AGAAPOLBHCRTR2CYP2D6 | |
| SCHEMBL17319526 | 0.88 | KMT2A (0.74) | KMT2AGAAPOLBCYP2C19TSHR | |
| SCHEMBL12471703 | 0.88 | KMT2A (0.74) | KMT2AGAAPOLBCYP2C19TSHR | |
| SCHEMBL6997222 | 0.87 | GAA (0.58) | KMT2AGAAPOLBHCRTR2CYP2D6 | |
| SCHEMBL7491535 | 0.86 | KMT2A (0.58) | KMT2AGAAPOLBHCRTR2MEN1 | |
| SCHEMBL10378752 | 0.86 | KMT2A (0.58) | KMT2AGAAPOLBHCRTR2MEN1 | |
| SCHEMBL24434796 | 0.86 | KMT2A (0.57) | KMT2AGAAHCRTR2CYP2D6CYP2C19 | |
| SCHEMBL927807 | 0.86 | KMT2A (0.57) | KMT2AGAAHCRTR2CYP2D6CYP2C19 | |
| SCHEMBL2583749 | 0.86 | KMT2A (0.57) | KMT2AGAAHCRTR2CYP2D6CYP2C19 | |
| SCHEMBL18217848 | 0.86 | GAA (0.60) | KMT2AGAAPOLBHCRTR2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110049985-B | Heterocyclic sulfones as ROR gamma modulators | 百时美施贵宝公司 | 2022-05-31 | — | — | CN | disclosed |
| CN-107709295-B | Tricyclic sulfones as ROR gamma modulators | 百时美施贵宝公司 | 2021-05-04 | — | — | CN | disclosed |