Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | PKLR | P30613 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 4/20 | 0.37 |
| ▸ | CA2 | P00918 | 4/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | HTR2B | P41595 | 2/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 2/20 | 0.37 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 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 | |
|---|---|---|---|---|
| SCHEMBL20502275 | 0.93 | PKM (0.42) | NOS3NOS1NOS2PKMPKLR | |
| SCHEMBL30605922 | 0.93 | PKM (0.42) | NOS3NOS1NOS2PKMPKLR | |
| SCHEMBL20674413 | 0.78 | PTGES2 (0.43) | CA1CA2PTGS2CA12PTGES2 | |
| SCHEMBL29469840 | 0.77 | HTR2C (0.40) | CA1CA2HTR2CHTR2BPTGS2 | |
| SCHEMBL1531218 | 0.75 | PTGS2 (0.42) | CA1CA2HTR2CHTR2BPTGS2 | |
| SCHEMBL677588 | 0.75 | CA1 (0.52) | PKMPKLRCA1CA2CA12 | |
| SCHEMBL29469904 | 0.73 | SLC6A2 (0.40) | PKMPKLRHTR2CPTGES2 | |
| SCHEMBL28562885 | 0.72 | ACMSD (0.43) | PKMCA1CA2PTGS2CA12 | |
| SCHEMBL434672 | 0.72 | KDM4E (0.50) | NOS3NOS1NOS2HTR2CHTR2B | |
| SCHEMBL5032032 | 0.72 | PTGES2 (0.46) | CA1CA2PTGS2CA12PTGES2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4229048-A1 | SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER | The Broad Institute, Inc. (US) | 2023-08-23 | — | — | EP | disclosed |
| WO-2022081807-A1 | SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER | THE BROAD INSTITUTE, INC. (US) | 2022-04-21 | — | — | WO | disclosed |