Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | RBP4 | P02753 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 3/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | GHSR | Q92847 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28022948 | 0.85 | POLB (0.43) | CA2CA1CA12CA14CA7 | |
| SCHEMBL26966759 | 0.85 | GRIN1 (0.46) | CA2CA1CA12CA14CA7 | |
| SCHEMBL2634144 | 0.84 | SPR (0.44) | CA2CA1CA12CA14CA7 | |
| SCHEMBL16014433 | 0.78 | RORC (0.46) | MMP1MMP9MMP13 | |
| SCHEMBL28897684 | 0.77 | LMNA (0.42) | CA2CA1CA12CA9LMNA | |
| SCHEMBL2412999 | 0.74 | CA2 (0.48) | CA2CA1CA12CA14CA9 | |
| SCHEMBL28379196 | 0.72 | GRIN1 (0.56) | — | |
| SCHEMBL28379197 | 0.72 | GRIN1 (0.56) | — | |
| SCHEMBL25296022 | 0.72 | LMNA (0.43) | CA2CA1CA12CA14CA7 | |
| SCHEMBL2930488 | 0.72 | ELOVL6 (0.43) | POLBLMNA |
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 |