Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | PLG | P00747 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 4/20 | 0.36 |
| ▸ | MIF | P14174 | 1/20 | 0.36 |
| ▸ | CSNK2A2 | P19784 | 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 | |
|---|---|---|---|---|
| SCHEMBL22601061 | 0.85 | CHRNA7 (0.40) | SMN1; SMN2NPC1TP53RAB9APKM | |
| SCHEMBL22601033 | 0.85 | NPC1 (0.51) | SMN1; SMN2NPC1TP53RAB9APKM | |
| SCHEMBL22600839 | 0.84 | RAB9A (0.41) | SMN1; SMN2NPC1TP53RAB9APKM | |
| SCHEMBL24314307 | 0.84 | RAB9A (0.45) | SMN1; SMN2NPC1TP53RAB9APKM | |
| SCHEMBL24313789 | 0.84 | NPC1 (0.43) | SMN1; SMN2NPC1TP53RAB9APKM | |
| SCHEMBL22601146 | 0.82 | NPC1 (0.39) | SMN1; SMN2NPC1TP53RAB9APKM | |
| SCHEMBL24313970 | 0.82 | ALDH1A1 (0.40) | SMN1; SMN2NPC1TP53RAB9APKM | |
| SCHEMBL24313952 | 0.82 | NPC1 (0.43) | SMN1; SMN2NPC1TP53RAB9APKM | |
| SCHEMBL24313793 | 0.82 | ALDH1A1 (0.42) | SMN1; SMN2NPC1TP53RAB9APKM | |
| SCHEMBL24313631 | 0.81 | HDAC6 (0.40) | SMN1; SMN2NPC1TP53RAB9APKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022081842-A1 | SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER | THE BROAD INSTITUTE, INC. (US) | 2022-04-21 | — | — | WO | disclosed |