Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 7/20 | 0.55 |
| ▸ | CA2 | P00918 | 7/20 | 0.55 |
| ▸ | CA9 | Q16790 | 7/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | RPA1 | P27694 | 1/20 | 0.47 |
| ▸ | CCKAR | P32238 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SLC16A3 | O15427 | 4/20 | 0.45 |
| ▸ | SLC16A1 | P53985 | 3/20 | 0.45 |
| ▸ | FABP3 | P05413 | 1/20 | 0.44 |
| ▸ | FABP4 | P15090 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28300981 | 0.89 | CCKAR (0.45) | CA1CA2CA9RPA1CCKAR | |
| SCHEMBL28301083 | 0.89 | CA1 (0.46) | CA1CA2CA9PTGS2RPA1 | |
| SCHEMBL28299743 | 0.84 | RAB9A (0.53) | PTGS2RPA1RAB9A | |
| SCHEMBL28299729 | 0.82 | NPC1 (0.46) | PTGS2RPA1RAB9AFABP3FABP4 | |
| SCHEMBL28873761 | 0.81 | NPSR1 (0.44) | RPA1RAB9ASLC16A3SLC16A1FABP3 | |
| SCHEMBL8689248 | 0.81 | CA9 (0.67) | CA1CA2CA9PTGS2 | |
| SCHEMBL9349960 | 0.80 | CA1 (0.77) | CA1CA2CA9PTGS2RPA1 | |
| SCHEMBL28847493 | 0.80 | GAA (0.40) | CA1CA2CA9PTGS2RPA1 | |
| SCHEMBL28301248 | 0.78 | GAA (0.49) | RAB9A | |
| SCHEMBL31130454 | 0.77 | SLC16A3 (0.68) | CA1CA2CA9SLC16A3SLC16A1 |
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-109890822-B | Inhibitors of cellular metabolic processes | 安吉奥斯医药品有限公司 | 2022-08-30 | — | — | CN | disclosed |
| CN-109890822-A | INHIBITORS OF CELLULAR METABOLIC PROCESSES | 安吉奥斯医药品有限公司 | 2019-06-14 | — | — | CN | disclosed |