Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.46 |
| ▸ | CA2 | P00918 | 5/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ALOX5AP | P20292 | 5/20 | 0.45 |
| ▸ | FEN1 | P39748 | 5/20 | 0.45 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA6 | P23280 | 2/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1094361 | 0.83 | CA1 (0.50) | CA1CA2CA9MAPK1ALOX5AP | |
| SCHEMBL29967288 | 0.80 | EDNRA (0.49) | CA1CA2CA9MAPK1ALOX5AP | |
| SCHEMBL1667127 | 0.80 | EDNRA (0.49) | CA1CA2CA9MAPK1ALOX5AP | |
| SCHEMBL8697131 | 0.80 | CA1 (0.47) | CA1CA2CA9MAPK1ALOX5AP | |
| SCHEMBL30372027 | 0.76 | TGFBR1 (0.42) | CA1CA2CA9MAPK1ALOX5AP | |
| Pyrimidine SCHEMBL16180729 | 0.75 | CA1 (0.44) | CA1CA2CA9MAPK1ALOX5AP | |
| SCHEMBL1094172 | 0.75 | CA2 (0.44) | CA1CA2CA9MAPK1ALOX5AP | |
| SCHEMBL8697589 | 0.73 | ALOX5AP (0.47) | CA1CA2CA9MAPK1ALOX5AP | |
| SCHEMBL7868583 | 0.73 | CDK9 (0.40) | CA1CA2CA9ALOX5APFEN1 | |
| SCHEMBL4669011 | 0.72 | ALOX5AP (0.49) | CA1CA2CA9MAPK1ALOX5AP |
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-2001081335-A1 | PYRIMIDINE-SULFONAMIDES HAVING ENDOTHELIN-ANTAGONIST ACTIVITY | ACTELION PHARMACEUTICALS LTD (CH) | 2001-11-01 | — | — | WO | claimed |