Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 12/20 | 0.69 |
| ▸ | CA1 | P00915 | 12/20 | 0.69 |
| ▸ | CA2 | P00918 | 12/20 | 0.69 |
| ▸ | CA9 | Q16790 | 12/20 | 0.69 |
| ▸ | CA4 | P22748 | 7/20 | 0.69 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | BCL9 | O00512 | 1/20 | 0.41 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4967425 | 0.99 | CA12 (0.68) | CA12CA1CA2CA9CA4 | |
| SCHEMBL4981144 | 0.95 | CA12 (0.66) | CA12CA1CA2CA9CA4 | |
| SCHEMBL13242624 | 0.84 | CA12 (0.46) | CA12CA1CA2CA9CA4 | |
| SCHEMBL17554594 | 0.83 | BCL9 (0.61) | CA12CA1CA2CA9CA4 | |
| SCHEMBL13242635 | 0.82 | KMT2A (0.46) | CA12CA1CA2CA9CA4 | |
| SCHEMBL4747250 | 0.81 | BCL9 (0.62) | CA12CA1CA2CA9CA4 | |
| SCHEMBL4965413 | 0.81 | KMT2A (0.47) | CA12CA1CA2CA9TSHR | |
| SCHEMBL14177869 | 0.81 | CA2 (0.44) | CA12CA1CA2CA9CA4 | |
| SCHEMBL28623815 | 0.80 | CA2 (0.58) | CA12CA1CA2CA9TSHR | |
| SCHEMBL4965576 | 0.79 | KMT2A (0.49) | CA12CA1CA2CA9TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008071421-A1 | NITRATE ESTERS OF CARBONIC ANHYDRASE INHIBITORS | NICOX S.A. (FR) | 2008-06-19 | — | — | WO | disclosed |