Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | G6PD | P11413 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29469816 | 1.00 | CYP2C9 (0.42) | CYP2C9CYP17A1CYP2C19ALDH1A1KDM4E | |
| SCHEMBL12015790 | 0.82 | CYP2C9 (0.43) | CYP2C9CYP17A1CYP2C19ALDH1A1KDM4E | |
| SCHEMBL12015804 | 0.82 | CYP2C9 (0.43) | CYP2C9CYP17A1CYP2C19ALDH1A1KDM4E | |
| SCHEMBL12015789 | 0.81 | MRGPRX4 (0.43) | CYP2C9CYP17A1CYP2C19ALDH1A1KDM4E | |
| SCHEMBL12015783 | 0.81 | NPC1 (0.48) | CYP2C9CYP17A1CYP2C19ALDH1A1KDM4E | |
| SCHEMBL19122117 | 0.80 | ALDH1A1 (0.45) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL31372046 | 0.79 | ACHE (0.37) | ALDH1A1BCHEACHESLC2A1 | |
| SCHEMBL13091267 | 0.79 | CYP17A1 (0.43) | CYP2C9CYP17A1CYP2C19ALDH1A1KDM4E | |
| SCHEMBL23902029 | 0.79 | RXRA (0.45) | CYP2C9CYP17A1CYP2C19ALDH1A1KDM4E | |
| SCHEMBL12015805 | 0.78 | CYP2C9 (0.40) | CYP2C9CYP17A1CYP2C19ALDH1A1KDM4E |
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-2022081842-A1 | SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER | THE BROAD INSTITUTE, INC. (US) | 2022-04-21 | — | — | WO | disclosed |
| WO-2022081807-A1 | SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER | THE BROAD INSTITUTE, INC. (US) | 2022-04-21 | — | — | WO | disclosed |