Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | HTR1D | P28221 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL10326175 | 0.75 | HTR1A (0.50) | DPP4GAACYP1A2CHRM5ADRA2C | |
| SCHEMBL8562869 | 0.75 | HTR1A (0.50) | DPP4GAACYP1A2CHRM5ADRA2C | |
| SCHEMBL10326397 | 0.75 | HTR1A (0.50) | DPP4GAACYP1A2CHRM5ADRA2C | |
| Hydrochloric Acid SCHEMBL11144978 | 0.74 | HTR1A (0.49) | DPP4GAACYP1A2CHRM5ADRA2C | |
| SCHEMBL1190922 | 0.73 | HTR1A (0.44) | DPP4GAAHTR1AHTR1DHTR2A | |
| SCHEMBL1190924 | 0.73 | HTR1A (0.44) | DPP4GAAHTR1AHTR1DHTR2A | |
| SCHEMBL7032911 | 0.73 | HTR1A (0.44) | DPP4GAAHTR1AHTR1DHTR2A | |
| Hydrochloric Acid SCHEMBL1190265 | 0.71 | HTR1A (0.43) | DPP4GAACYP1A2HTR1AHTR1D | |
| Hydrochloric Acid SCHEMBL27899317 | 0.71 | HTR1A (0.43) | DPP4GAACYP1A2HTR1AHTR1D | |
| SCHEMBL6965380 | 0.69 | GAA (0.40) | DPP4GAACYP1A2ADRA2CHTR1A |
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-0821674-B1 | CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | SEARLE & CO (US) | 2003-08-06 | — | — | EP | claimed |