Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 8/20 | 0.44 |
| ▸ | CA1 | P00915 | 6/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 9/20 | 0.41 |
| ▸ | CES1 | P23141 | 5/20 | 0.41 |
| ▸ | CES2 | O00748 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 5/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonamide SCHEMBL1046210 | 0.92 | CA2 (0.48) | EPHX1CA2CA1CA7CA13 | |
| Trifluoromethanesulfonic Acid SCHEMBL29065725 | 0.84 | EPHX1 (0.48) | EPHX1FAAHCES1CES2MEN1 | |
| SCHEMBL2833314 | 0.84 | EPHX1 (0.44) | EPHX1FAAHCES1CES2MEN1 | |
| SCHEMBL6115342 | 0.81 | EPHX1 (0.55) | EPHX1FAAHCES1CES2MEN1 | |
| SCHEMBL29091682 | 0.80 | CA2 (0.52) | CA2CA1CA7FAAHCES2 | |
| Octadecylamine SCHEMBL17220490 | 0.79 | DNM1 (0.56) | EPHX1CA2CA1CA7CA13 | |
| Trifluoromethanesulfonamide SCHEMBL22582763 | 0.78 | SLC22A1 (0.54) | EPHX1CA2CA1CA7CA13 | |
| Trifluoromethanesulfonic Acid SCHEMBL28416043 | 0.75 | EPHX1 (0.42) | EPHX1FAAHCES1CES2MEN1 | |
| Trifluoromethanesulfonamide SCHEMBL28388248 | 0.75 | CA2 (0.69) | EPHX1CA2CA1CA7CA13 | |
| SCHEMBL23758978 | 0.75 | TSHR (0.57) | EPHX1MEN1KMT2AHSD17B10 |
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-2012053768-A2 | ARYLOXYPHENOXYACETYL-BASED COMPOUND HAVING HIF-1 INHIBITION ACTIVITY, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME AS AN ACTIVE INGREDIENT | KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) | 2012-04-26 | — | — | WO | disclosed |