Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRR1 | P24046 | 5/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | PPP5C | P53041 | 1/20 | 0.35 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.33 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | PEPD | P12955 | 1/20 | 0.32 |
| ▸ | GABRR2 | P28476 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19857354 | 1.00 | GABRR1 (0.37) | GABRR1EPHX1PPP5CSLC1A2SLC1A1 | |
| SCHEMBL7635619 | 1.00 | GABRR1 (0.37) | GABRR1EPHX1PPP5CSLC1A2SLC1A1 | |
| SCHEMBL2865585 | 1.00 | GABRR1 (0.37) | GABRR1EPHX1PPP5CSLC1A2SLC1A1 | |
| SCHEMBL2865583 | 1.00 | GABRR1 (0.37) | GABRR1EPHX1PPP5CSLC1A2SLC1A1 | |
| SCHEMBL2869805 | 0.84 | GABRR1 (0.39) | GABRR1PPP5CSLC1A2SLC1A1GRM2 | |
| SCHEMBL2869807 | 0.84 | GABRR1 (0.39) | GABRR1PPP5CSLC1A2SLC1A1GRM2 | |
| SCHEMBL20625191 | 0.84 | GABRR1 (0.39) | GABRR1PPP5CSLC1A2SLC1A1GRM2 | |
| SCHEMBL17803105 | 0.84 | GABRR1 (0.39) | GABRR1PPP5CSLC1A2SLC1A1GRM2 | |
| SCHEMBL14186720 | 0.83 | — | — | |
| SCHEMBL18375852 | 0.83 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6375943-B1 | ETHYL (1R,2R,5R)-5-IODO-2-METHYLCYCLOHEXANE-1-CARBOXYLATE IN AN ENANTOMERIC EXCESS OF AT LEAST 70%. | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE | 2002-04-23 | — | — | US | disclosed |