Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 4/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7506577 | 0.87 | PNMT (0.44) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL7511439 | 0.84 | PNMT (0.37) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL7512695 | 0.82 | F2 (0.31) | — | |
| SCHEMBL8305510 | 0.81 | CA12 (0.34) | — | |
| SCHEMBL7510864 | 0.79 | — | — | |
| SCHEMBL8307723 | 0.77 | DRD2 (0.32) | — | |
| SCHEMBL7513395 | 0.76 | MAOA (0.39) | — | |
| SCHEMBL8309882 | 0.75 | DRD2 (0.46) | — | |
| SCHEMBL7512428 | 0.75 | L3MBTL3 (0.31) | — | |
| SCHEMBL8309546 | 0.73 | FYN (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0861250-B1 | AMIDINE AND ISOTHIOUREA DERIVATIVES AS INHIBITORS OF NITRIC OXIDE SYNTHASE | ASTRAZENECA AB (SE) | 2002-02-13 | — | — | EP | claimed |