Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
| ▸ | WDR5 | P61964 | 1/20 | 0.43 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | C1S | P09871 | 2/20 | 0.40 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.40 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | EDNRB | P24530 | 1/20 | 0.39 |
| ▸ | EDNRA | P25101 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24699123 | 1.00 | CA2 (0.46) | CA2CA1CA9CA5AWDR5 | |
| SCHEMBL264103 | 0.83 | CA2 (0.70) | CA2CA1CA9CA5ACA12 | |
| Hydrochloric Acid SCHEMBL3531213 | 0.81 | CA2 (0.67) | CA2CA1CA9CA5ACA12 | |
| SCHEMBL18640198 | 0.79 | HSD17B2 (0.43) | CA2CA1CA9CA5AWDR5 | |
| SCHEMBL5610108 | 0.78 | ATM (0.45) | CA2CA1CA9CA5AWDR5 | |
| SCHEMBL31391247 | 0.78 | LMNA (0.54) | WDR5HSD17B2ATMMMP2PGR | |
| SCHEMBL31668877 | 0.78 | LMNA (0.54) | WDR5HSD17B2ATMMMP2PGR | |
| SCHEMBL3679487 | 0.78 | LMNA (0.54) | WDR5HSD17B2ATMMMP2PGR | |
| Sulfuric Acid SCHEMBL28377517 | 0.76 | CA2 (0.59) | CA2CA1CA9CA5ACA12 | |
| Boric Acid SCHEMBL28695399 | 0.76 | CA2 (0.59) | CA2CA1CA9CA5AWDR5 |
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-4313967-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2024-02-07 | — | — | EP | disclosed |
| WO-2022212194-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-10-06 | — | — | WO | disclosed |