Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Clonidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A known ✓ | P08913 | 12/20 | 1.00 |
| ▸ | ADRA2B known ✓ | P18089 | 9/20 | 1.00 |
| ▸ | ADRA2C known ✓ | P18825 | 9/20 | 1.00 |
| ▸ | LMNA | P02545 | 5/20 | 1.00 |
| ▸ | ADRA1A | P35348 | 4/20 | 1.00 |
| ▸ | ADRA1D | P25100 | 3/20 | 1.00 |
| ▸ | ADRA1B | P35368 | 3/20 | 1.00 |
| ▸ | BLM | P54132 | 3/20 | 1.00 |
| ▸ | HTR2A | P28223 | 1/20 | 1.00 |
| ▸ | HTR2C | P28335 | 1/20 | 1.00 |
| ▸ | HTR7 | P34969 | 1/20 | 1.00 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 1.00 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 1.00 |
| ▸ | NISCH | Q9Y2I1 | 3/20 | 0.97 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.97 |
| ▸ | HRH2 | P25021 | 2/20 | 0.97 |
| ▸ | MEN1 | O00255 | 1/20 | 0.97 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.97 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.97 |
| ▸ | HTR1A | P08908 | 1/20 | 0.97 |
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 | |
|---|---|---|---|---|
| Clonidine SCHEMBL40752 | 1.00 | ADRA2A (1.00) | ADRA2AADRA2BADRA2CLMNAADRA1A | |
| Clonidine SCHEMBL5983 | 0.98 | ADRA2A (1.00) | ADRA2AADRA2BADRA2CLMNAADRA1A | |
| Clonidine SCHEMBL613364 | 0.97 | ADRA2A (0.97) | ADRA2AADRA2BADRA2CLMNAADRA1A | |
| Clonidine SCHEMBL9838990 | 0.97 | ADRA2A (0.97) | ADRA2AADRA2BADRA2CLMNAADRA1A | |
| Clonidine SCHEMBL18050245 | 0.89 | ADRA2A (0.82) | ADRA2AADRA2BADRA2CLMNAADRA1A | |
| SCHEMBL29352531 | 0.88 | ADRA2A (0.81) | ADRA2AADRA2BADRA2CLMNAADRA1A | |
| SCHEMBL12225936 | 0.87 | ADRA2A (0.79) | ADRA2AADRA2BADRA2CLMNAADRA1A | |
| SCHEMBL11176814 | 0.87 | ADRA2A (0.79) | ADRA2AADRA2BADRA2CLMNAADRA1A | |
| SCHEMBL9920135 | 0.87 | ADRA2A (0.79) | ADRA2AADRA2BADRA2CLMNAADRA1A | |
| SCHEMBL11157545 | 0.87 | ADRA2A (0.76) | ADRA2AADRA2BADRA2CLMNAADRA1A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011089216-A1 | DIPEPTIDE-BASED PRODRUG LINKERS FOR ALIPHATIC AMINE-CONTAINING DRUGS | ASCENDIS PHARMA AS (DK) | 2011-07-28 | — | — | WO | disclosed |
| US-4558063-A | INHIBIT SMALL INTESTINE SECRETION | BEECHAM GROUP P.L.C. (GB) | 1985-12-10 | — | — | US | disclosed |
| EP-0043659-B1 | CLONIDINE DERIVATIVES USEFUL IN THE TREATMENT OF DIARRHOEA | BEECHAM GROUP PLC (GB) | 1985-02-06 | — | — | EP | disclosed |
| US-4450170-A | A P-AMINO CLONIDINE ALONG WITH AN ORAL HYDRATION AGENT; ANTISECRETORY AGENTS | BEECHAM GROUP LIMITED (GB) | 1984-05-22 | — | — | US | disclosed |
| EP-0043659-A1 | Clonidine derivatives useful in the treatment of diarrhoea | BEECHAM GROUP PLC (GB) | 1982-01-13 | — | — | EP | disclosed |