Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 5/20 | 0.71 |
| ▸ | HTR1B | P28222 | 4/20 | 0.71 |
| ▸ | ADRA2C | P18825 | 8/20 | 0.67 |
| ▸ | ADRA2A | P08913 | 7/20 | 0.67 |
| ▸ | ADRA2B | P18089 | 7/20 | 0.67 |
| ▸ | ADRA1A | P35348 | 5/20 | 0.67 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.67 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.67 |
| ▸ | BLM | P54132 | 3/20 | 0.65 |
| ▸ | CFB | P00751 | 6/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10973842 | 0.98 | HTR1D (0.69) | HTR1DHTR1BADRA2CADRA2AADRA2B | |
| SCHEMBL11187565 | 0.86 | HTR1D (0.76) | HTR1DHTR1BADRA2CADRA2AADRA2B | |
| Apraclonidine SCHEMBL34128 | 0.80 | ADRA2A (1.00) | HTR1DHTR1BADRA2CADRA2AADRA2B | |
| SCHEMBL10977629 | 0.80 | ADRA2C (0.67) | HTR1DHTR1BADRA2CADRA2AADRA2B | |
| SCHEMBL4760243 | 0.79 | HTR1D (1.00) | HTR1DHTR1BADRA2CADRA2AADRA2B | |
| Apraclonidine SCHEMBL1649431 | 0.79 | ADRA2A (0.97) | HTR1DHTR1BADRA2CADRA2AADRA2B | |
| Apraclonidine SCHEMBL1002875 | 0.79 | BLM (1.00) | HTR1DHTR1BADRA2CADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL29384552 | 0.78 | HTR1D (0.97) | HTR1DHTR1BADRA2CADRA2AADRA2B | |
| SCHEMBL6581982 | 0.75 | HTR1D (0.54) | HTR1DHTR1BADRA2CADRA2AADRA2B | |
| SCHEMBL6054534 | 0.74 | HTR1D (0.58) | HTR1DHTR1BADRA2CADRA2AADRA2B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |