Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | CA3 | P07451 | 1/20 | 0.56 |
| ▸ | CA4 | P22748 | 1/20 | 0.56 |
| ▸ | CA6 | P23280 | 1/20 | 0.56 |
| ▸ | CA5A | P35218 | 1/20 | 0.56 |
| ▸ | CA7 | P43166 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.56 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.56 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.56 |
| ▸ | DRD1 | P21728 | 1/20 | 0.56 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | IKBKB | O14920 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28022385 | 0.82 | KAT6A (0.53) | CA12CA1CA2CA3CA4 | |
| SCHEMBL28820849 | 0.82 | PARG (0.55) | PTGS2SMN1; SMN2CYP2A6LMNASCD | |
| SCHEMBL28022299 | 0.80 | PTGS2 (0.73) | DRD1PTGS2CYP2A6SCDPTGS1 | |
| SCHEMBL10781024 | 0.80 | VCAM1 (0.53) | CA12CA1CA2CA3CA4 | |
| SCHEMBL5028730 | 0.80 | CYP2A6 (0.58) | CA1CA2PTGS2CYP2A6SCD | |
| SCHEMBL2690063 | 0.79 | DRD1 (0.56) | CA12CA1CA2CA3CA4 | |
| SCHEMBL3382108 | 0.78 | CYP2A6 (0.56) | CA1CA2PTGS2CYP2A6SCD | |
| SCHEMBL3906959 | 0.77 | NR3C2 (0.61) | CA12CA1CA2CA3CA4 | |
| SCHEMBL8080277 | 0.77 | SMN1; SMN2 (0.70) | CA12CA1CA2CA3CA4 | |
| SCHEMBL28820907 | 0.77 | PTGS2 (0.73) | CA12CA1CA2CA3CA4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105102449-A | Antiviral compounds | HOFFMANN LA ROCHE | 2015-11-25 | — | — | CN | disclosed |