Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.44 |
| ▸ | ESRRG | P62508 | 7/20 | 0.36 |
| ▸ | ESR1 | P03372 | 5/20 | 0.36 |
| ▸ | ESRRB | O95718 | 3/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | ESRRA | P11474 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2565961 | 1.00 | HRH3 (0.44) | HRH3ESRRGESR1ESRRBKCNH2 | |
| SCHEMBL2563353 | 1.00 | HRH3 (0.44) | HRH3ESRRGESR1ESRRBKCNH2 | |
| SCHEMBL2565320 | 0.99 | HRH3 (0.43) | HRH3ESRRGESR1ESRRBKCNH2 | |
| SCHEMBL2563412 | 0.85 | HRH3 (0.41) | HRH3ESRRGESR1ESRRBKCNH2 | |
| SCHEMBL2565894 | 0.85 | HRH3 (0.41) | HRH3ESRRGESR1ESRRBKCNH2 | |
| SCHEMBL2563612 | 0.85 | HRH3 (0.41) | HRH3ESRRGESR1ESRRBKCNH2 | |
| SCHEMBL2560474 | 0.84 | BCHE (0.41) | HRH3ESRRGESR1ESRRBKCNH2 | |
| Oxalic Acid SCHEMBL5229363 | 0.81 | HRH3 (0.44) | HRH3ESRRGESR1ESRRBKCNH2 | |
| SCHEMBL2562679 | 0.75 | HRH3 (0.52) | HRH3ESRRGESR1ESRRBKCNH2 | |
| SCHEMBL2564277 | 0.75 | HRH3 (0.52) | HRH3ESRRGESR1ESRRBKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1960387-B1 | ISOQUINOLINE ET BENZO[H]ISOQUINOLINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF AS ANTAGONISTS OF HISTAMINE H3 RECEPTOR | SANOFI SA (FR) | 2011-11-02 | — | — | EP | claimed |
| EP-1960387-B1 | ISOQUINOLINE ET BENZO[H]ISOQUINOLINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF AS ANTAGONISTS OF HISTAMINE H3 RECEPTOR | SANOFI SA (FR) | 2011-11-02 | — | — | EP | disclosed |