Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8122389 | 0.85 | CES1 (0.47) | CES1 | |
| SCHEMBL8557868 | 0.79 | CES1 (0.34) | CES1 | |
| SCHEMBL8557286 | 0.76 | CES1 (0.37) | CES1 | |
| SCHEMBL8559761 | 0.74 | AKR1B1 (0.40) | CES1CA12CA9 | |
| SCHEMBL8128202 | 0.73 | GRIN2D (0.41) | CES1 | |
| SCHEMBL8554501 | 0.72 | HTR2C (0.37) | CES1 | |
| SCHEMBL8120664 | 0.72 | EGFR (0.40) | — | |
| SCHEMBL8556891 | 0.71 | RET (0.37) | CES1GAACA12CA9 | |
| SCHEMBL8123432 | 0.71 | CES1 (0.37) | CES1 | |
| SCHEMBL8127567 | 0.71 | CES1 (0.37) | CES1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0647137-A4 | GLYCINE RECEPTOR ANTAGONISTS AND THE USE THEREOF. | UNIV CALIFORNIA WEBER ECKARD (US) | 1998-09-16 | — | — | EP | disclosed |
| EP-0647137-A1 | GLYCINE RECEPTOR ANTAGONISTS AND THE USE THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1995-04-12 | — | — | EP | disclosed |