Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 4/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.42 |
| ▸ | ESR1 | P03372 | 8/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 0.36 |
| ▸ | PTGIR | P43119 | 3/20 | 0.36 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 SCHEMBL4749089 | 0.99 | ADRA2A (0.41) | ADRA2AADRA2BADRA2CESR1ESR2 | |
| SCHEMBL4788602 | 0.93 | NISCH (0.44) | ADRA2AADRA2BADRA2CCYP1A2CYP3A4 | |
| SCHEMBL4788401 | 0.93 | KDM4E (0.44) | ADRA2AADRA2BADRA2CCYP1A2CYP3A4 | |
| SCHEMBL4788571 | 0.92 | CYP19A1 (0.46) | ADRA2AADRA2BADRA2CESR1ESR2 | |
| Acetic Acid SCHEMBL4787678 | 0.88 | MAOA (0.42) | ESR1ESR2ALDH1A1CYP1A2CYP3A4 | |
| Acetic Acid SCHEMBL4787766 | 0.88 | OPRM1 (0.41) | CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL949042 | 0.83 | KDM4E (0.52) | ADRA2AADRA2BADRA2CPTGIRCYP1A2 | |
| SCHEMBL4788015 | 0.83 | MAOB (0.43) | ADRA2AADRA2BADRA2CHTR1BALDH1A1 | |
| Iodide SCHEMBL951481 | 0.82 | KDM4E (0.51) | ADRA2AADRA2BADRA2CPTGIRCYP1A2 | |
| SCHEMBL4785397 | 0.80 | PTGIR (0.47) | ADRA2AADRA2BADRA2CPTGIRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008123821-A1 | 4, 5-DIHYDRO-LH-IMIDAZOL-2-AMINE DERIVATIVES FOR USE IN THE TREATMENT OF RESPIRATORY, CARDIOVASCULAR, NEUROLOGICAL OR GASTROINTESTINAL DISORDERS | ALBIREO AB (SE) | 2008-10-16 | — | — | WO | claimed |
| WO-2008123821-A1 | 4, 5-DIHYDRO-LH-IMIDAZOL-2-AMINE DERIVATIVES FOR USE IN THE TREATMENT OF RESPIRATORY, CARDIOVASCULAR, NEUROLOGICAL OR GASTROINTESTINAL DISORDERS | ALBIREO AB (SE) | 2008-10-16 | — | — | WO | disclosed |