Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.37 |
| ▸ | SPHK1 | Q9NYA1 | 4/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.36 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.36 |
| ▸ | ACLY | P53396 | 1/20 | 0.36 |
| ▸ | GHSR | Q92847 | 2/20 | 0.36 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.36 |
| ▸ | THRA | P10827 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL3945536 | 0.90 | EPHX1 (0.42) | EPHX1EPHX2CA12CA1CA2 | |
| SCHEMBL3948169 | 0.85 | EPHX1 (0.43) | EPHX1EPHX2CA12CA1CA2 | |
| Trifluoroacetic Acid SCHEMBL3943200 | 0.83 | EPHX2 (0.64) | EPHX1EPHX2CA12CA1CA2 | |
| Iodide SCHEMBL3944404 | 0.78 | EPHX1 (0.44) | EPHX1EPHX2CA12CA1CA2 | |
| Trifluoroacetic Acid SCHEMBL3945551 | 0.77 | EPHX2 (0.61) | EPHX1EPHX2CA12CA1CA2 | |
| Trifluoroacetic Acid SCHEMBL3948166 | 0.76 | EPHX1 (0.45) | EPHX1EPHX2FAAHSPHK1POLB | |
| Trifluoroacetic Acid SCHEMBL978194 | 0.76 | CA12 (0.36) | EPHX1EPHX2CA12CA1CA2 | |
| Trifluoroacetic Acid SCHEMBL982583 | 0.75 | CA12 (0.38) | CA12CA1CA2CA9FAAH | |
| Trifluoroacetic Acid SCHEMBL3939649 | 0.74 | EPHX2 (0.65) | EPHX1EPHX2CA12CA1CA2 | |
| Trifluoroacetic Acid SCHEMBL978408 | 0.71 | HPGD (0.39) | CA12CA1CA2CA9FAAH |
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-2009015485-A1 | CYCLIC INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER | UNIVERSITY HEALTH NETWORK (CA) | 2009-02-05 | — | — | WO | disclosed |